Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 4/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | TTR | P02766 | 1/20 | 0.31 |
| ▸ | ACACB | O00763 | 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 | |
|---|---|---|---|---|
| SCHEMBL5155292 | 0.73 | NPC1 (0.39) | MCHR1CHRM1HTR2ABACE1ACACB | |
| SCHEMBL2325485 | 0.72 | MCHR1 (0.54) | MCHR1CHRM1HTR2ABACE1 | |
| SCHEMBL6381920 | 0.71 | MCHR1 (0.39) | MCHR1CHRM1HTR2ABACE1 | |
| SCHEMBL2322808 | 0.68 | BACE1 (0.46) | MCHR1CHRM1HTR2ABACE1GRM5 | |
| SCHEMBL2322357 | 0.64 | MCHR1 (0.71) | MCHR1CHRM1HTR2A | |
| SCHEMBL2328403 | 0.62 | NPC1 (0.46) | MCHR1CHRM1HTR2A | |
| SCHEMBL2321084 | 0.58 | MCHR1 (0.58) | MCHR1CHRM1HTR2ABACE1 | |
| SCHEMBL12884284 | 0.58 | TTR (0.56) | BACE1GRM5TTR | |
| SCHEMBL28255967 | 0.56 | BACE1 (0.63) | MCHR1BACE1 | |
| SCHEMBL4480442 | 0.56 | MCHR1 (0.78) | MCHR1CHRM1HTR2A |
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-1740572-A1 | NOVEL ALKYNE COMPOUNDS WITH AN MCH-ANTAGONISTIC ACTION AND MEDICAMENTS CONTAINING SAID COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-01-10 | — | — | EP | claimed |
| WO-2005103031-A1 | NOVEL ALKYNE COMPOUNDS WITH AN MCH-ANTAGONISTIC ACTION AND MEDICAMENTS CONTAINING SAID COMPOUNDS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2005-11-03 | — | — | WO | claimed |