Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8553406 | 0.86 | RAB9A (0.40) | MMP1MMP3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8550273 | 0.85 | RAB9A (0.42) | CYP1A2CYP3A4CYP2D6CYP2C19RAB9A | |
| Hydrochloric Acid SCHEMBL8551600 | 0.84 | BCHE (0.42) | ADAMTS5TAAR1RAB9ANPC1POLB | |
| SCHEMBL8552889 | 0.84 | RAB9A (0.42) | CYP1A2CYP3A4CYP2D6CYP2C19RAB9A | |
| SCHEMBL8556190 | 0.83 | RAB9A (0.40) | MMP1MMP3CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL8552242 | 0.83 | RAB9A (0.42) | CYP1A2CYP3A4CYP2D6CYP2C19RAB9A | |
| SCHEMBL8552015 | 0.82 | RAB9A (0.43) | RAB9ANPC1POLBSMN1; SMN2TDP1 | |
| SCHEMBL8553401 | 0.82 | RAB9A (0.41) | CYP1A2CYP3A4RAB9ANPC1POLB | |
| SCHEMBL8552916 | 0.81 | RAB9A (0.40) | CYP1A2CYP3A4CYP2D6CYP2C19RAB9A | |
| SCHEMBL8557953 | 0.81 | BCHE (0.46) | ADAMTS5TAAR1RAB9ANPC1POLB |
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-0871442-A1 | BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1998-10-21 | — | — | EP | disclosed |
| WO-1997025041-A1 | BENZIMIDZOLYL NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1997-07-17 | — | — | WO | disclosed |