Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 16/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL6229659 | 0.87 | MCHR1 (0.67) | MCHR1KCNH2RAB9ASMN1; SMN2 | |
| SCHEMBL6235183 | 0.84 | RAB9A (0.49) | MCHR1KCNH2RAB9ASMN1; SMN2ESR1 | |
| SCHEMBL5936175 | 0.79 | MCHR1 (0.71) | MCHR1KCNH2 | |
| SCHEMBL6268295 | 0.75 | RAB9A (0.44) | MCHR1KCNH2RAB9ASMN1; SMN2ESR1 | |
| SCHEMBL2412433 | 0.72 | HDAC1 (0.47) | — | |
| SCHEMBL5936051 | 0.71 | MCHR1 (0.58) | MCHR1KCNH2 | |
| SCHEMBL5936063 | 0.70 | MCHR1 (0.61) | MCHR1KCNH2 | |
| SCHEMBL5766960 | 0.68 | MCHR1 (1.00) | MCHR1KCNH2 | |
| SCHEMBL3276372 | 0.68 | NR4A2 (0.47) | — | |
| SCHEMBL5936028 | 0.67 | MCHR1 (1.00) | MCHR1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004092181-A9 | HETEROCYCLIC MCHR1 ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2005-01-27 | — | — | WO | disclosed |