Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | IDO1 | P14902 | 2/20 | 0.56 |
| ▸ | HTR2A | P28223 | 2/20 | 0.55 |
| ▸ | HTR2B | P41595 | 2/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | MLYCD | O95822 | 1/20 | 0.54 |
| ▸ | ACP3 | P15309 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.53 |
| ▸ | MIF | P14174 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4239980 | 0.88 | DPP7 (0.59) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL46769 | 0.84 | MLYCD (0.55) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL15129325 | 0.84 | TAAR1 (0.55) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL29988585 | 0.84 | MRGPRX4 (0.57) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL4368141 | 0.84 | TAAR1 (0.59) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL42728 | 0.84 | MRGPRX4 (0.57) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL18901273 | 0.84 | TAAR1 (0.55) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| Bromide SCHEMBL29093720 | 0.82 | TAAR1 (0.53) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| Hydrochloric Acid SCHEMBL8701788 | 0.82 | IDO1 (0.54) | TAAR1IDO1HTR2AHTR2BHTR2C | |
| SCHEMBL4245195 | 0.82 | DPP7 (0.55) | TAAR1IDO1HTR2AHTR2BHTR2C |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2414346-A1 | AUTOTAXIN INHIBITORS | Merck Patent GmbH (DE) | 2012-02-08 | — | — | EP | claimed |
| WO-2010112124-A1 | AUTOTAXIN INHIBITORS | MERCK PATENT GMBH (DE) | 2010-10-07 | — | — | WO | claimed |
| CN-108135168-A | CCR2 modulators | 凯莫森特里克斯股份有限公司 | 2018-06-08 | — | — | CN | disclosed |
| CN-105505128-B | Near-infrared light response self-repairing coating and preparation method thereof | 南京工业大学 | 2018-05-08 | — | — | CN | disclosed |
| CN-103102303-B | As the benzyl amine derivative of CETP inhibitor | DR. REDDY'S LABORATORIES LTD. (IN) | 2015-10-28 | — | — | CN | disclosed |
| CN-104962543-A | Oriented immobilization method for bacillus subtilis neutral protease | UNIV SHANGHAI SCIENCE & TECH | 2015-10-07 | — | — | CN | disclosed |
| CN-104151319-A | Selective substituted pyridine ligands for neuronal nicotinic receptors | ABBVIE INC | 2014-11-19 | — | — | CN | disclosed |
| CN-103172562-A | Trisubstituted amine compounds as inhibitors of cholesteryl ester transfer protein CETP | TANABE SEIYAKU CO | 2013-06-26 | — | — | CN | disclosed |
| EP-2440294-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS | Janssen Pharmaceutica, N.V. (BE) | 2012-04-18 | — | — | EP | disclosed |
| WO-2010144680-A1 | BENZIMIDAZOLE DERIVATIVES USEFUL AS TRPM8 CHANNEL MODULATORS | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-16 | — | — | WO | disclosed |
| WO-2006103342-A9 | INDANYL-PIPERAZINE DERIVATIVES, METHOD FOR PREPARING SAME AND PHARMACEUTICAL COMPOSITIONS CONTAINING SAME | SERVIER LAB (FR) | 2007-10-25 | — | — | WO | disclosed |