Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 6/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | GFER | P55789 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TRPC3 | Q13507 | 1/20 | 0.39 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.37 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL13895004 | 0.87 | DGAT1 (0.49) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13895002 | 0.84 | TRPC3 (0.48) | DGAT1KCNH2NPC1TP53HPGD | |
| SCHEMBL13887352 | 0.84 | MCHR1 (0.57) | MCHR1NPC1TP53HPGDTSHR | |
| SCHEMBL13894921 | 0.84 | GFER (0.56) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13894864 | 0.84 | GFER (0.53) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13894938 | 0.83 | GFER (0.58) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13895003 | 0.83 | TRPC3 (0.45) | DGAT1KCNH2NPC1TP53HPGD | |
| SCHEMBL13894936 | 0.81 | TRPC3 (0.61) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13894780 | 0.81 | TP53 (0.49) | DGAT1KCNH2MCHR1NPC1TP53 | |
| SCHEMBL13895105 | 0.80 | TRPC3 (0.43) | DGAT1KCNH2MCHR1NPC1TP53 |
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-7524862-B2 | Alkyne compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-04-28 | — | — | US | disclosed |