Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.94 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.94 |
| ▸ | TSHR | P16473 | 6/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.50 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 2/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.38 |
| ▸ | AHR | P35869 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | METAP2 | P50579 | 1/20 | 0.35 |
| ▸ | METAP1 | P53582 | 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 | |
|---|---|---|---|---|
| SCHEMBL136940 | 0.97 | CYP3A4 (1.00) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| SCHEMBL27375138 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| SCHEMBL27287703 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| SCHEMBL11876110 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| SCHEMBL2812523 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| Methane SCHEMBL28776381 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| Hydrochloric Acid SCHEMBL11673852 | 0.94 | CYP3A4 (0.94) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| Ethane SCHEMBL28069740 | 0.92 | CYP3A4 (0.89) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| Methyl Alcohol SCHEMBL28055212 | 0.92 | CYP3A4 (0.89) | CYP3A4MAPK1TSHRHSD17B10HPGD | |
| SCHEMBL11119604 | 0.92 | CYP3A4 (0.89) | CYP3A4MAPK1TSHRHSD17B10HPGD |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1010780-B | IMPROVING CATALYST PRODUCTIVITY IN POLYMERIZATION OF OLEFINS | UNION CARBIDE CORP (US) | 1990-12-12 | — | — | CN | disclosed |