Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | TEAD2 | Q15562 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | NR2F2 | P24468 | 2/20 | 0.35 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8698701 | 0.94 | ALDH1A1 (0.43) | ALDH1A1KDM4ENPC1MAPK1KDR | |
| SCHEMBL8693502 | 0.91 | ALDH1A1 (0.46) | ALDH1A1KDM4ENPC1MAPK1TEAD2 | |
| SCHEMBL8696169 | 0.85 | ALDH1A1 (0.48) | ALDH1A1KDM4ENPC1MAPK1KMT2A | |
| SCHEMBL8692971 | 0.84 | ALDH1A1 (0.42) | ALDH1A1KDM4ENPC1MAPK1KDR | |
| SCHEMBL8693117 | 0.83 | MAPT (0.50) | ALDH1A1NPC1KMT2ALMNANPSR1 | |
| SCHEMBL8692506 | 0.83 | TEAD2 (0.39) | ALDH1A1KDM4ETEAD2KMT2ALMNA | |
| SCHEMBL8694568 | 0.83 | TEAD2 (0.39) | ALDH1A1KDM4ETEAD2KMT2ALMNA | |
| SCHEMBL8698684 | 0.81 | CNR2 (0.43) | ALDH1A1NPC1KMT2ALMNANPSR1 | |
| SCHEMBL8694246 | 0.79 | TEAD2 (0.41) | ALDH1A1KDM4ETEAD2KMT2AMAPT | |
| SCHEMBL8696980 | 0.79 | TEAD2 (0.37) | ALDH1A1KDM4ETEAD2KMT2ALMNA |
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-5849779-A | Pyrazole derivatives and their pharmaceutical use | JAPAN ENERGY CORPORATION (JP) | 1998-12-15 | — | — | US | disclosed |
| EP-0810217-A1 | Pyrazole derivatives and their pharmaceutical use as smooth muscle cell growth inhibitors | JAPAN ENERGY CORPORATION (JP) | 1997-12-03 | — | — | EP | disclosed |