Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | HPGD | P15428 | 4/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.33 |
| ▸ | POLB | P06746 | 4/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 4/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8085805 | 0.70 | ALDH1A1 (0.40) | KDM4ENPSR1ALDH1A1HPGDTDP1 | |
| SCHEMBL11606838 | 0.69 | ALDH1A1 (0.40) | KDM4EALDH1A1HPGDTDP1POLB | |
| SCHEMBL30343473 | 0.66 | BCAT2 (0.53) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL5188338 | 0.66 | BCAT2 (0.53) | KDM4EALDH1A1HPGDPOLBHSD17B10 | |
| SCHEMBL38652499 | 0.66 | ALDH1A1 (0.39) | KDM4ENPSR1ALDH1A1HPGDTDP1 | |
| SCHEMBL28780435 | 0.66 | AURKA (0.41) | KDM4EL3MBTL1PARP1 | |
| SCHEMBL18920575 | 0.63 | KEAP1 (0.44) | KDM4ENPSR1ALDH1A1HPGDTDP1 | |
| SCHEMBL1981395 | 0.62 | ALDH1A1 (0.47) | KDM4ENPSR1ALDH1A1HPGDPOLB | |
| SCHEMBL30174272 | 0.62 | ALOX15 (0.38) | KDM4ENPSR1ALDH1A1HPGDPOLB | |
| SCHEMBL18920571 | 0.62 | IKBKB (0.43) | KDM4ENPSR1ALDH1A1HPGDTDP1 |
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-2004623-A1 | PYRIDYL- AND PYRIMIDINYL-SUBSTITUTED PYRROLE-, THIOPHENE- AND FURANE-DERIVATIVES AS KINASE INHIBITORS | Nerviano Medical Sciences S.r.l. (IT) | 2008-12-24 | — | — | EP | disclosed |
| WO-2007110344-A1 | PYRIDYL- AND PYRIMIDINYL-SUBSTITUTED PYRROLE-, THIOPHENE- AND FURANE-DERIVATIVES AS KINASE INHIBITORS | NERVIANO MEDICAL SCIENCES S.R.L. (IT) | 2007-10-04 | — | — | WO | disclosed |