Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.31 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5596608 | 0.86 | ALDH1A1 (0.43) | ALDH1A1TRPA1KDM4EHPGDHSD17B10 | |
| SCHEMBL5596158 | 0.81 | ESR1 (0.35) | ESR1ESR2 | |
| SCHEMBL5596075 | 0.80 | ALDH1A1 (0.39) | ALDH1A1KDM4EKMT2AESR1ESR2 | |
| SCHEMBL5596935 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TRPA1KDM4EHPGDHSD17B10 | |
| SCHEMBL5596115 | 0.79 | CA2 (0.48) | ALDH1A1CYP3A4CYP2C9KMT2AESR1 | |
| SCHEMBL5596914 | 0.78 | ESR1 (0.41) | ALDH1A1KDM4EHPGDHSD17B10CYP3A4 | |
| SCHEMBL5596484 | 0.75 | MEN1 (0.38) | ALDH1A1KDM4EHPGDHSD17B10CYP3A4 | |
| SCHEMBL5596535 | 0.71 | NPC1 (0.39) | ALDH1A1KDM4EHPGDCYP3A4KMT2A | |
| SCHEMBL5596382 | 0.71 | TRPA1 (0.39) | ALDH1A1TRPA1HPGDHSD17B10KMT2A | |
| SCHEMBL5596906 | 0.71 | ALDH1A1 (0.50) | ALDH1A1TRPA1KDM4EHPGDHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-7279537-B2 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-10-09 | — | — | US | disclosed |
| US-20060229195-A1 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-10-12 | — | — | US | disclosed |
| EP-1557423-A1 | TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS | Sumitomo Chemical Company, Limited (JP) | 2005-07-27 | — | — | EP | disclosed |