Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | LPL | P06858 | 2/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 2/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.30 |
| ▸ | HTR2C | P28335 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9758110 | 0.96 | MAOA (0.38) | MAOAMAOBOPRM1OPRK1OPRL1 | |
| SCHEMBL9759087 | 0.91 | CYP1A2 (0.41) | MAOAMAOBOPRM1OPRK1OPRL1 | |
| SCHEMBL9757785 | 0.90 | MAOA (0.38) | MAOAMAOBOPRM1OPRK1OPRL1 | |
| SCHEMBL9759834 | 0.90 | SPHK1 (0.40) | HRH3LPLLIPGBCHEHTR2A | |
| SCHEMBL9758777 | 0.89 | MAOA (0.35) | MAOAMAOBOPRM1OPRK1OPRL1 | |
| SCHEMBL9758652 | 0.88 | MAOA (0.37) | MAOAMAOBHRH3BCHECYP2C9 | |
| SCHEMBL9758033 | 0.87 | CYP1A2 (0.38) | MAOAMAOBOPRM1OPRK1OPRL1 | |
| SCHEMBL9757852 | 0.86 | MAOA (0.36) | MAOAMAOBHRH3BCHEMAPT | |
| SCHEMBL9758966 | 0.85 | TSHR (0.37) | MAOAMAOBHRH3MAPTCYP2C9 | |
| SCHEMBL9759208 | 0.85 | NISCH (0.34) | MAOAMAOBOPRM1OPRK1OPRL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |
| EP-0154849-A2 | Cyclohexane derivatives | MERCK PATENT GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |