Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.49 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | VCP | P55072 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.43 |
| ▸ | WNT3A | P56704 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 4/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | KDM6B | O15054 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30898828 | 1.00 | HSP90AA1 (0.49) | HSP90AA1NTSR1FFAR1KMT2AVCP | |
| SCHEMBL2560784 | 0.83 | FFAR1 (0.50) | FFAR1KMT2AGRM5CYP1A2LMNA | |
| SCHEMBL9133103 | 0.83 | APP (0.52) | KMT2AVCPGRM5SMN1; SMN2NPC1 | |
| SCHEMBL1390131 | 0.81 | GRM5 (0.50) | FFAR1VCPGRM5CYP1A2KCNH2 | |
| SCHEMBL18104914 | 0.81 | FFAR1 (0.47) | FFAR1GRM5CYP1A2LMNANAPRT | |
| SCHEMBL30475553 | 0.78 | FFAR1 (0.45) | FFAR1GRM5CYP1A2L3MBTL1KCNH2 | |
| SCHEMBL13382197 | 0.78 | GRM5 (0.49) | FFAR1GRM5CYP1A2L3MBTL1KCNH2 | |
| SCHEMBL3641140 | 0.75 | RAB9A (0.45) | FFAR1KMT2AGRM5SMN1; SMN2NPC1 | |
| Methyl Alcohol SCHEMBL28902013 | 0.74 | GRM5 (0.67) | FFAR1GRM5CYP1A2L3MBTL1KCNH2 | |
| SCHEMBL20089267 | 0.74 | GRM5 (0.45) | FFAR1GRM5CYP1A2L3MBTL1KCNH2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0476645-B1 | Calcium uptake inhibitors | MERRELL DOW PHARMA (US) | 1995-09-06 | — | — | EP | disclosed |
| US-5409942-A | Administering 1-phenyl-3-aryl-2-propyne-1-ones compounds | MERRELL DOW PHARMACEUTICALS INC. (US) | 1995-04-25 | — | — | US | disclosed |
| US-5223518-A | Controlling intake in leukocytes and platelets | MERRELL DOW PHARMACEUTICALS INC. (US) | 1993-06-29 | — | — | US | disclosed |
| EP-0476645-A1 | Calcium uptake inhibitors | MERRELL DOW PHARMACEUTICALS INC. (US) | 1992-03-25 | — | — | EP | disclosed |