Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | FAAH | O00519 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | PNLIP | P16233 | 1/20 | 0.45 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.45 |
| ▸ | STK39 | Q9UEW8 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CNR1 | P21554 | 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 | |
|---|---|---|---|---|
| SCHEMBL9106342 | 0.89 | ALDH1A1 (0.51) | SMN1; SMN2HPGDALDH1A1HTTLMNA | |
| SCHEMBL9106921 | 0.87 | HPGD (0.48) | SMN1; SMN2HPGDFAAHALDH1A1LMNA | |
| SCHEMBL4472396 | 0.82 | HTT (0.54) | SMN1; SMN2HPGDALDH1A1ALOX12HTT | |
| SCHEMBL5406539 | 0.81 | SMN1; SMN2 (0.64) | SMN1; SMN2HPGDFAAHALDH1A1ALOX12 | |
| SCHEMBL5725866 | 0.79 | CDK8 (0.50) | FAAHHTTMAPTRAB9A | |
| SCHEMBL5725295 | 0.78 | ICMT (0.46) | MAPTNPC1RAB9A | |
| SCHEMBL5729489 | 0.75 | PORCN (0.46) | SMN1; SMN2HPGDALDH1A1HTTLMNA | |
| Phenyl 4-Chlorophenylcarbamate SCHEMBL6258165 | 0.75 | ALDH1A1 (0.70) | SMN1; SMN2FAAHALDH1A1HTTLMNA | |
| SCHEMBL21295428 | 0.73 | SMN1; SMN2 (0.74) | SMN1; SMN2HPGDFAAHALDH1A1HTT | |
| SCHEMBL4473380 | 0.73 | ALDH1A1 (0.57) | SMN1; SMN2HPGDALDH1A1HTTLMNA |
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-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |