Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MMP2 | P08253 | 2/20 | 0.33 |
| ▸ | MMP9 | P14780 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 2/20 | 0.33 |
| ▸ | CA9 | Q16790 | 2/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | MMP13 | P45452 | 1/20 | 0.33 |
| ▸ | SERPINE1 | P05121 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 3/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL17838825 | 1.00 | THRB (0.39) | THRBMEN1KMT2AMMP2MMP9 | |
| SCHEMBL28592040 | 1.00 | THRB (0.39) | THRBMEN1KMT2AMMP2MMP9 | |
| SCHEMBL28376339 | 1.00 | THRB (0.39) | THRBMEN1KMT2AMMP2MMP9 | |
| SCHEMBL20739473 | 1.00 | THRB (0.39) | THRBMEN1KMT2AMMP2MMP9 | |
| SCHEMBL28470103 | 0.98 | THRB (0.38) | THRBMEN1KMT2AMMP2MMP9 | |
| Hydrochloric Acid SCHEMBL28379328 | 0.98 | THRB (0.38) | THRBMEN1KMT2AMMP2MMP9 | |
| SCHEMBL16096102 | 0.95 | THRB (0.33) | THRBMEN1KMT2AATM | |
| SCHEMBL28474752 | 0.95 | THRB (0.33) | THRBMEN1KMT2AATM | |
| SCHEMBL16096104 | 0.95 | THRB (0.33) | THRBMEN1KMT2AATM | |
| SCHEMBL28603771 | 0.95 | THRB (0.33) | THRBMEN1KMT2AATM |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113121562-B | Polycyclic compounds as inhibitors of bruton's tyrosine kinase | 詹森药业有限公司 | 2022-09-13 | — | — | CN | disclosed |
| WO-2022150962-A1 | PROTEASE INHIBITORS, PREPARATION, AND USES THEREOF | WESTLAKE PHARMACEUTICAL (HANGZHOU) CO., LTD. (CN) | 2022-07-21 | — | — | WO | disclosed |
| CN-113614095-A | Alkylboronic acids as arginase inhibitors | 广东新契生物医药科技有限公司 | 2021-11-05 | — | — | CN | disclosed |
| CN-113121562-A | Polycyclic compounds as inhibitors of bruton's tyrosine kinase | 詹森药业有限公司 | 2021-07-16 | — | — | CN | disclosed |
| CN-109498812-A | HSP90 combination treatment | 索隆-基特林癌症研究协会 | 2019-03-22 | — | — | CN | disclosed |
| CN-103998935-B | Hsp90 combination therapy | 索隆-基特林癌症研究协会 | 2018-10-16 | — | — | CN | disclosed |
| CN-106008322-B | sulfonamide derivatives as BC L-2-selective apoptosis-inducing agents for the treatment of cancer and immune diseases | ABBVIE 公司 | 2018-09-04 | — | — | CN | disclosed |
| WO-2018103060-A1 | INHIBITORS OF BRUTON'S TYROSINE KINASE AND METHODS OF THEIR USE | JANSSEN PHARMACEUTICA NV (BE) | 2018-06-14 | — | — | WO | disclosed |
| CN-108026088-A | Oxadiazole derivatives as HDAC inhibitors | 武田药品工业株式会社 | 2018-05-11 | — | — | CN | disclosed |
| CN-104159904-B | Thienopyrimidine compounds | 霍夫曼-拉罗奇有限公司 | 2016-12-14 | — | — | CN | disclosed |
| CN-106008322-A | BCL-2-selectively apoptosis-inducing agents for the treatment of cancer and immune diseases | ABBVIE 公司 | 2016-10-12 | — | — | CN | disclosed |
| CN-104159891-B | Pyridazine amide compound and they are as the purposes of SYK inhibitor | 霍夫曼-拉罗奇有限公司 | 2016-09-07 | — | — | CN | disclosed |
| CN-102753548-B | Fused heteroaromatic pyrrolidones as SYK inhibitors | TAKAEDA CHEMICAL IND LTD | 2015-03-11 | — | — | CN | disclosed |
| CN-103313968-A | Nampt and rock inhibitors | ABBVIE LAB | 2013-09-18 | — | — | CN | disclosed |
| CN-101932556-B | Diurethane compound, process for producing the same, and acrylic rubber composition containing the same | UNIMATEC CO LTD | 2013-08-14 | — | — | CN | disclosed |
| CN-102574854-A | Macrocyclic integrase inhibitors | ELANCO ANIMAL HEALTH IRELAND | 2012-07-11 | — | — | CN | disclosed |
| CN-102016064-A | Nucleoside triphosphates with electroactive label bound to gamma phosphate | HEINZ-BERNHARD KRAATZ | 2011-04-13 | — | — | CN | disclosed |
| CN-101932556-A | Novel diurethane compound, process for producing the same, and acrylic rubber composition containing the same | UNIMATEC CO LTD | 2010-12-29 | — | — | CN | disclosed |