Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10595411 | 0.83 | ALDH1A1 (0.51) | CYP3A4CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL11077787 | 0.70 | MEN1 (0.40) | ALDH1A1MAPK1HIF1ASMN1; SMN2TSHR | |
| SCHEMBL9664110 | 0.70 | MAPK1 (0.44) | CYP3A4ALDH1A1MAPK1HIF1ASMN1; SMN2 | |
| SCHEMBL11077794 | 0.69 | ALDH1A1 (0.39) | ALDH1A1MAPK1HIF1ASMN1; SMN2TSHR | |
| SCHEMBL10455909 | 0.69 | ALDH1A1 (0.50) | CYP3A4CYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL10594821 | 0.69 | ADRA2C (0.40) | CYP1A2SMN1; SMN2HPGDLMNA | |
| SCHEMBL10367993 | 0.68 | ALDH1A1 (0.46) | CYP3A4ALDH1A1MAPK1HIF1ASMN1; SMN2 | |
| SCHEMBL9664124 | 0.68 | ALDH1A1 (0.50) | CYP3A4ALDH1A1MAPK1HIF1ASMN1; SMN2 | |
| SCHEMBL992504 | 0.68 | ALDH1A1 (0.48) | CYP3A4ALDH1A1MAPK1HIF1ASMN1; SMN2 | |
| SCHEMBL8091206 | 0.68 | POLB (0.49) | CYP3A4CYP1A2CYP2C9CYP2C19ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0089100-B1 | AZOLYL DERIVATIVES AS FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1989-05-31 | — | — | EP | disclosed |
| US-4518415-A | PLANT GROWTH REGULATORS, FUNGICIDES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1985-05-21 | — | — | US | disclosed |
| EP-0089100-A2 | Azolyl derivatives as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-09-21 | — | — | EP | disclosed |