Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 4/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.32 |
| ▸ | EYA2 | O00167 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.31 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | USP2 | O75604 | 1/20 | 0.31 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TTR | P02766 | 1/20 | 0.31 |
| ▸ | ALB | P02768 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10089364 | 0.84 | CYP2C19 (0.41) | CYP2C19CYP2C9EYA2MEN1ABCC4 | |
| SCHEMBL10089359 | 0.74 | CYP2C19 (0.42) | CYP2C19CYP2C9EYA2MEN1ABCC4 | |
| SCHEMBL10089354 | 0.65 | CYP1A2 (0.36) | CYP2C19MEN1ALDH1A1LMNACYP1A2 | |
| SCHEMBL10089369 | 0.61 | EGFR (0.39) | CYP2C19CYP2C9ALDH1A1LMNACYP1A2 | |
| SCHEMBL27649528 | 0.60 | EYA3 (0.43) | CYP2C19CYP2C9EYA2MEN1ABCC4 | |
| SCHEMBL10089380 | 0.59 | CYP2A6 (0.37) | ALDH1A1MAPTHPGD | |
| SCHEMBL28104532 | 0.57 | CYP2C19 (0.62) | CYP2C19CYP2C9EYA2MEN1ABCC4 | |
| SCHEMBL11750759 | 0.55 | EYA3 (0.55) | CYP2C19CYP2C9EYA2MEN1ABCC4 | |
| SCHEMBL15912542 | 0.55 | HSP90AA1 (0.48) | CYP2C19CYP2C9MEN1NR1I2ALDH1A1 | |
| SCHEMBL10089384 | 0.55 | MAPT (0.38) | CYP2C19ALDH1A1LMNACYP1A2POLB |
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 |
|---|---|---|---|---|---|---|---|
| US-20120029159-A1 | POLYDENTATE HETEROATOM LIGAND CONTAINING METAL COMPLEXES, CATALYSTS AND METHODS OF MAKING AND USING THE SAME | DOW GLOBAL TECHNOLOGIES LLC (US) | 2012-02-02 | — | — | US | disclosed |