Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 5/20 | 0.37 |
| ▸ | RAB9A | P51151 | 5/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
| ▸ | RELA | Q04206 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | CETP | P11597 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9720050 | 0.81 | TSHR (0.46) | NPC1RAB9AMAPTHPGDALDH1A1 | |
| SCHEMBL8184437 | 0.76 | DRD2 (0.50) | NPC1RAB9ATSHR | |
| SCHEMBL9711010 | 0.74 | DRD2 (0.39) | CETP | |
| SCHEMBL17186185 | 0.74 | TAAR1 (0.47) | MAPTTP53ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL30496730 | 0.74 | TAAR1 (0.47) | MAPTTP53ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL4179106 | 0.72 | HTR2C (0.46) | CYP2D6 | |
| Hydrochloric Acid SCHEMBL5157753 | 0.72 | TDP1 (0.48) | MAPTTP53ALDH1A1CYP1A2CYP2D6 | |
| SCHEMBL30496717 | 0.72 | TAAR1 (0.45) | MAPTTP53ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL5079011 | 0.72 | TAAR1 (0.45) | MAPTTP53ALDH1A1CYP1A2CYP2C19 | |
| SCHEMBL7701701 | 0.72 | TAAR1 (0.52) | DAOSMN1; SMN2HTTALDH1A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1461313-B1 | HUMAN ADAM-10 INHIBITORS | EXELIXIS INC (US) | 2009-08-05 | — | — | EP | disclosed |