Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8696343 | 0.96 | ALDH1A1 (0.47) | EPHX1ALDH1A1HTTLMNACREBBP | |
| SCHEMBL8593357 | 0.92 | ALDH1A1 (0.48) | ALDH1A1HTTLMNACREBBPPOLB | |
| SCHEMBL8693140 | 0.90 | ALDH1A1 (0.45) | ALDH1A1LMNACREBBPPOLBKDM4E | |
| SCHEMBL8696100 | 0.89 | EPHX1 (0.52) | EPHX1ALDH1A1HTTCREBBPPOLB | |
| SCHEMBL8693552 | 0.87 | MAPT (0.54) | ALDH1A1LMNAPOLBKDM4ETSHR | |
| SCHEMBL8695984 | 0.87 | EPHX1 (0.42) | EPHX1ALDH1A1HTTKDM4ETSHR | |
| SCHEMBL8694236 | 0.86 | ALDH1A1 (0.46) | ALDH1A1HTTLMNACREBBPKDM4E | |
| SCHEMBL8698725 | 0.86 | EPHX1 (0.41) | EPHX1ALDH1A1HTTKDM4ETSHR | |
| SCHEMBL8693110 | 0.86 | EPHX1 (0.41) | EPHX1ALDH1A1HTTKDM4ETSHR | |
| SCHEMBL8696177 | 0.84 | ALDH1A1 (0.46) | EPHX1ALDH1A1HTTCREBBPPOLB |
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 |