Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC5R | P33032 | 4/20 | 0.54 |
| ▸ | MC4R | P32245 | 3/20 | 0.54 |
| ▸ | MC3R | P41968 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | MC1R | Q01726 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | CASR | P41180 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12752954 | 0.82 | CYP1A2 (0.53) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL21058258 | 0.80 | SIGMAR1 (0.45) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL7316409 | 0.78 | IDO1 (0.46) | CYP1A2IDO1CA12CA1CA2 | |
| SCHEMBL27962081 | 0.74 | CYP1A2 (0.52) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL29577338 | 0.73 | PNMT (0.52) | IDO1 | |
| SCHEMBL6747065 | 0.73 | CYP1A2 (0.43) | CYP1A2CYP2A6IDO1MAPK1CA12 | |
| SCHEMBL29286763 | 0.72 | MC5R (0.57) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL11445189 | 0.72 | MC5R (0.61) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL30054430 | 0.72 | CYP1A2 (0.59) | MC5RMC4RMC3RCYP1A2CYP2A6 | |
| SCHEMBL1035887 | 0.72 | CYP1A2 (0.59) | MC5RMC4RMC3RCYP1A2CYP2A6 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6699873-B1 | EATING DISORDERS | MILLENNIUM PHARMACEUTICALS, INC. | 2004-03-02 | — | — | US | disclosed |