Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | IMPDH2 | P12268 | 2/20 | 0.33 |
| ▸ | IMPDH1 | P20839 | 2/20 | 0.33 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.31 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | BRAF | P15056 | 1/20 | 0.31 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7285369 | 0.81 | CDK5 (0.50) | ALDH1A1KDM4EGAAMAPTCDK5 | |
| SCHEMBL11331683 | 0.74 | KDR (0.44) | ALDH1A1KDM4EGAAMAPTCDK5 | |
| SCHEMBL3291503 | 0.70 | PARP1 (0.57) | ALDH1A1KDM4EGAAMAPTMCL1 | |
| SCHEMBL16420006 | 0.70 | ALDH1A1 (0.50) | ALDH1A1KDM4EGAAMAPTIMPDH2 | |
| SCHEMBL10620743 | 0.68 | KDM4E (0.57) | ALDH1A1KDM4EGAAMAPTIMPDH2 | |
| SCHEMBL17502200 | 0.68 | KDM4E (0.57) | ALDH1A1KDM4EGAAMAPTIMPDH2 | |
| SCHEMBL30427308 | 0.68 | KDM4E (0.57) | ALDH1A1KDM4EGAAMAPTIMPDH2 | |
| SCHEMBL2637424 | 0.67 | ALDH1A1 (0.46) | ALDH1A1KDM4EGAAMAPTMCL1 | |
| SCHEMBL20586425 | 0.67 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAAMAPTIMPDH2 | |
| SCHEMBL7285017 | 0.66 | KDM4E (0.54) | ALDH1A1KDM4EGAAMAPTCDK5 |
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 |
|---|---|---|---|---|---|---|---|
| US-5081131-A | Omega-((hetero)alkyl)benz(cd)-indol-2-amines | AMERICAN CYANAMID COMPANY (US) | 1992-01-14 | — | — | US | disclosed |
| EP-0230035-A2 | Omega-[(hetero)alkyl]benz[cd]indol-2-amines | AMERICAN CYANAMID COMPANY (US) | 1987-07-29 | — | — | EP | disclosed |