Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | KMO | O15229 | 2/20 | 0.43 |
| ▸ | ALPL | P05186 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11073103 | 0.80 | CYP1A2 (0.53) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL6319050 | 0.76 | KMO (0.43) | KMOGRIN2B | |
| SCHEMBL8165871 | 0.76 | CA12 (0.41) | CA12CA1CA2CA9KMO | |
| SCHEMBL10960418 | 0.76 | CA12 (0.47) | CA12CA1CA2CA9CYP1A2 | |
| SCHEMBL7707702 | 0.76 | KMO (0.42) | KMOGRIN2B | |
| SCHEMBL7474145 | 0.76 | ALDH1A1 (0.40) | KMOALPLALDH1A1DPP4KDM4E | |
| SCHEMBL30722849 | 0.74 | HDAC3 (0.56) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9081963 | 0.74 | KMO (0.40) | KMOGRIN2B | |
| SCHEMBL28906210 | 0.73 | ALDH1A1 (0.48) | ALPLALDH1A1KDM4EGAAHPGD | |
| SCHEMBL14800515 | 0.73 | MAPT (0.50) | ALPLCYP1A2CYP2C19DPP4KDM4E |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0769008-B1 | PYRAZOLE DERIVATIVES AS HERBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2002-05-22 | — | — | EP | disclosed |
| US-6083881-A | Pyrazole derivatives as herbicides | NOVARTIS CORPORATION (US) | 2000-07-04 | — | — | US | disclosed |
| EP-0769008-A1 | PYRAZOLE DERIVATIVES AS HERBICIDES | Novartis AG (CH) | 1997-04-23 | — | — | EP | disclosed |
| WO-1996001254-A1 | PYRAZOLE DERIVATIVES AS HERBICIDES | CIBA-GEIGY AG (CH) | 1996-01-18 | — | — | WO | disclosed |