Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAP2K4 | P45985 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | DHODH | Q02127 | 1/20 | 0.37 |
| ▸ | MAPKAPK3 | Q16644 | 1/20 | 0.37 |
| ▸ | MAPK6 | Q16659 | 1/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 2/20 | 0.37 |
| ▸ | PBRM1 | Q86U86 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL29954027 | 1.00 | PARP1 (0.43) | PARP1HSD17B10KDM4EHPGDALDH1A1 | |
| SCHEMBL700007 | 0.81 | KDM4E (0.47) | HSD17B10KDM4EALDH1A1LMNARAB9A | |
| SCHEMBL13987127 | 0.81 | MAP2K4 (0.37) | HSD17B10KDM4EALDH1A1CYP1A2MAP2K4 | |
| SCHEMBL29955478 | 0.79 | IMPDH2 (0.38) | PARP1HSD17B10KDM4EALDH1A1CYP1A2 | |
| SCHEMBL28497966 | 0.79 | PARP1 (0.45) | PARP1HSD17B10KDM4EHPGDALDH1A1 | |
| SCHEMBL2019158 | 0.78 | GAA (0.54) | PARP1KDM4ENAPRTKDRPLK4 | |
| SCHEMBL28503102 | 0.78 | PARP1 (0.44) | PARP1HSD17B10KDM4EHPGDALDH1A1 | |
| SCHEMBL29955303 | 0.77 | CYP2A6 (0.39) | HSD17B10KDM4EALDH1A1CYP1A2MAP2K4 | |
| SCHEMBL3535995 | 0.77 | CYP2A6 (0.39) | HSD17B10KDM4EALDH1A1CYP1A2MAP2K4 | |
| SCHEMBL29956256 | 0.76 | MAP2K4 (0.37) | HSD17B10KDM4EHPGDALDH1A1MAP2K4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6891044-B2 | Indazole compounds and pharmaceutical compositions for Inhibiting protein kinases, and methods for their use | AGOURON PHARMACEUTICALS, INC. (US) | 2005-05-10 | — | — | US | disclosed |