Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | DHODH | Q02127 | 3/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| 4-Nitroaniline SCHEMBL7841864 | 1.00 | ALDH1A1 (0.54) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL1892085 | 0.94 | ALDH1A1 (0.59) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL16522194 | 0.94 | ALDH1A1 (0.59) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL1892083 | 0.94 | ALDH1A1 (0.59) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL11241197 | 0.81 | RAB9A (0.54) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL11241195 | 0.81 | RAB9A (0.54) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL5256107 | 0.81 | KDM4E (0.69) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL5256103 | 0.81 | KDM4E (0.69) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL537859 | 0.80 | DHODH (0.69) | ALDH1A1MAPTKDM4EKMT2ALMNA | |
| SCHEMBL23899149 | 0.79 | ALDH1A1 (0.57) | ALDH1A1MAPTKDM4EKMT2ALMNA |
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-1117659-A1 | SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS | American Cyanamid Company (US) | 2001-07-25 | — | — | EP | disclosed |
| WO-2000018761-A1 | SUBSTITUTED 3-CYANOQUINOLINES AS PROTEIN TYROSINE KINASES INHIBITORS | AMERICAN CYANAMID COMPANY (US) | 2000-04-06 | — | — | WO | disclosed |