Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC5R | P33032 | 5/20 | 0.64 |
| ▸ | MC4R | P32245 | 3/20 | 0.64 |
| ▸ | MC3R | P41968 | 3/20 | 0.60 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | MC1R | Q01726 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 1/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL6008141 | 0.88 | MC5R (0.71) | MC5RMC4RMC3RROCK1MAPK1 | |
| SCHEMBL4017226 | 0.86 | MC5R (0.65) | MC5RMC4RMC3RROCK1MAPK1 | |
| SCHEMBL7250915 | 0.85 | MC5R (0.69) | MC5RMC4RMC3RROCK1MAPK1 | |
| Hydrochloric Acid SCHEMBL31120720 | 0.85 | MC5R (0.62) | MC5RMC4RMC3RROCK1MAPK1 | |
| Hydrochloric Acid SCHEMBL31120721 | 0.85 | MC5R (0.62) | MC5RMC4RMC3RROCK1MAPK1 | |
| SCHEMBL5703579 | 0.81 | MC5R (0.59) | MC5RMC4RMC3RROCK1MAPK1 | |
| SCHEMBL27502280 | 0.81 | MC5R (0.59) | MC5RMC4RMC3RROCK1MAPK1 | |
| Hydrochloric Acid SCHEMBL6417210 | 0.80 | MC5R (0.57) | MC5RMC4RMC3RROCK1MAPK1 | |
| SCHEMBL2125786 | 0.79 | TDP1 (0.55) | ALDH1A1CYP3A4CA12CA1CA2 | |
| SCHEMBL8826336 | 0.79 | KDM4E (0.63) | MC5RMC4RMC3RROCK1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1514112-B1 | METHOD FOR IDENTIFYING AN ALLOSTERIC EFFECTOR OF A RECEPTOR | CENTRE NAT RECH SCIENT (FR) | 2006-09-06 | — | — | EP | disclosed |
| US-20060194259-A1 | Method for isolating an allosteric effector of a receptor | UNIVERSITE LOUIS PASTEUR DE STRASSOURG (FR) | 2006-08-31 | — | — | US | disclosed |