Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TNFRSF1A | P19438 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PLIN5 | Q00G26 | 1/20 | 0.39 |
| ▸ | ABHD5 | Q8WTS1 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4535147 | 0.85 | CYP2C19 (0.49) | CYP2C19CYP3A4GLATDP1MAPT | |
| SCHEMBL4780260 | 0.84 | CYP3A4 (0.49) | CYP2C19CYP3A4GLATDP1TNFRSF1A | |
| Ethylene SCHEMBL17997367 | 0.82 | CYP2C19 (0.52) | CYP2C19GLATDP1MAPTMAOB | |
| SCHEMBL26917 | 0.82 | CYP2C19 (0.55) | CYP2C19GLATDP1MAPTMAOB | |
| SCHEMBL3259240 | 0.82 | CYP2C19 (0.55) | CYP2C19GLATDP1MAPTMAOB | |
| SCHEMBL6286942 | 0.82 | CYP2C19 (0.55) | CYP2C19GLATDP1MAPTMAOB | |
| SCHEMBL28939716 | 0.82 | CYP2C19 (0.55) | CYP2C19GLATDP1MAPTMAOB | |
| Benzene SCHEMBL27345987 | 0.82 | CYP2C19 (0.55) | CYP2C19GLATDP1MAPTMAOB | |
| SCHEMBL6578306 | 0.81 | CYP2C19 (0.42) | CYP2C19CYP3A4TDP1TNFRSF1AMAPT | |
| Butadiene SCHEMBL7155720 | 0.81 | CYP2C19 (0.50) | CYP2C19GLATDP1MAPTMAOB |
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-5916986-A | Coating composition for coatings resistant to environmental etch | BASF CORPORATION (US) | 1999-06-29 | — | — | US | disclosed |
| EP-0196872-A2 | Molding composition containing functionalised thermoplastic rubber and method | ARCO CHEMICAL TECHNOLOGY, INC. (US) | 1986-10-08 | — | — | EP | disclosed |
| US-4500021-A | Resealable articles and process | ESCHEM, INC. (US) | 1985-02-19 | — | — | US | disclosed |