Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.71 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.69 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.69 |
| ▸ | HTT | P42858 | 1/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.68 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.68 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14679114 | 0.84 | CYP2D6 (0.73) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| SCHEMBL2399935 | 0.83 | HTT (0.96) | HDAC8HDAC6HTTCYP2C9CYP2C19 | |
| SCHEMBL3117145 | 0.83 | CYP2D6 (0.67) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| SCHEMBL2989541 | 0.83 | CYP2D6 (0.67) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| SCHEMBL15153463 | 0.83 | CYP2D6 (0.71) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| SCHEMBL14590778 | 0.83 | HTT (0.65) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| SCHEMBL12083635 | 0.82 | CYP2D6 (0.54) | CYP2D6HDAC8HDAC6HTTCYP2C9 | |
| N-Piperidinobenzamide SCHEMBL696161 | 0.81 | HTT (1.00) | HTTCYP2C9GAANPC1RAB9A | |
| SCHEMBL9282775 | 0.81 | HTT (1.00) | HTTCYP2C9GAANPC1RAB9A | |
| SCHEMBL7453939 | 0.81 | HDAC8 (0.72) | CYP2D6HDAC8HDAC6CYP2C9CYP2C19 |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111601790-B | Heteroaryl compounds as protein kinase inhibitors | 福建海西新药创制股份有限公司 | 2023-03-31 | — | — | CN | claimed |
| CN-113135922-A | Azacycloheptane [4,3,2-cd ] isoindol-2-one derivatives and application thereof | 中国药科大学 | 2021-07-20 | — | — | CN | claimed |
| CN-109923114-A | Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer | 因赛特公司 | 2019-06-21 | — | — | CN | claimed |
| CN-104072498-B | (R) synthetic method of N [5 (2 methoxyl group 2 phenyl acetyl) 1,4,5,6 nafoxidines also [3,4 c] pyrazoles 3 base] 4 (4 methyl piperazine 1 base) Benzoylamide | 沈阳药科大学 | 2016-12-28 | — | — | CN | claimed |
| WO-2011039344-A1 | PYRIMIDINE DERIVATIVES AS PROTEIN TYROSINE KINASE 2 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-04-07 | — | — | WO | claimed |
| CN-116715625-A | Heteroaryl compounds as protein kinase inhibitors | 福建海西新药创制股份有限公司 | 2023-09-08 | — | — | CN | disclosed |
| WO-2023161844-A1 | USE OF HPK1 INHIBITOR IN TREATMENT OF INTERFERON-RELATED DISEASES | 智宠制药（北京）有限公司 | 2023-08-31 | — | — | WO | disclosed |
| CN-111601790-B | Heteroaryl compounds as protein kinase inhibitors | 福建海西新药创制股份有限公司 | 2023-03-31 | — | — | CN | disclosed |
| WO-2020022636-A1 | COMPOUND HAVING TRKA INHIBITORY ACTIVITY AND PHARMACEUTICAL COMPOSITION, FOR PREVENTING OR ALLEVIATING PAIN, CONTAINING SAME AS ACTIVE INGREDIENT | 주식회사 제이씨파마 | 2020-01-30 | — | — | WO | disclosed |
| WO-2019238067-A1 | PYRROLO [2, 3-B] PYRIDINES OR PYRROLO [2, 3-B] PYRAZINES AS HPK1 INHIBITOR AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2019-12-19 | — | — | WO | disclosed |
| CN-109923114-A | Pyrazolopyridine derivatives as HPK1 modulators and their use for the treatment of cancer | 因赛特公司 | 2019-06-21 | — | — | CN | disclosed |
| CN-109310690-A | Isoquinolin -3- base benzamide type and its preparation and its purposes | 萨穆梅德有限公司 | 2019-02-05 | — | — | CN | disclosed |
| CN-104072498-B | (R) synthetic method of N [5 (2 methoxyl group 2 phenyl acetyl) 1,4,5,6 nafoxidines also [3,4 c] pyrazoles 3 base] 4 (4 methyl piperazine 1 base) Benzoylamide | 沈阳药科大学 | 2016-12-28 | — | — | CN | disclosed |
| WO-2011039344-A1 | PYRIMIDINE DERIVATIVES AS PROTEIN TYROSINE KINASE 2 INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-04-07 | — | — | WO | disclosed |
| CN-101910168-A | Tropane compounds | EXELIXIS INC | 2010-12-08 | — | — | CN | disclosed |