Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | PAM | P19021 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 3/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | GRIK1 | P39086 | 2/20 | 0.41 |
| ▸ | GRIK2 | Q13002 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8995849 | 0.88 | CYP2C19 (0.57) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL8995848 | 0.88 | CYP2C19 (0.57) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL17386403 | 0.81 | CYP2C19 (0.46) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL27314003 | 0.78 | BLM (0.49) | CYP2C19NPC1TSHREGFRGLA | |
| SCHEMBL4298429 | 0.78 | MMP1 (0.46) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL1716940 | 0.77 | PAM (0.53) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL1716939 | 0.77 | PAM (0.53) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL10619280 | 0.77 | PAM (0.53) | CYP2C19PAMNPC1TSHREGFR | |
| SCHEMBL20036796 | 0.76 | TDP1 (0.47) | CYP2C19PAMTSHREGFRMMP1 | |
| SCHEMBL29697102 | 0.75 | BLM (0.54) | CYP2C19EGFRTDP1MAPTKMT2A |
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-0494716-B1 | Enzyme-catalysed preparation of optically active carboxylic acids | DSM NV (NL) | 1996-08-28 | — | — | EP | disclosed |
| US-5248608-A | Enzyme catalyzed stereospecific hdyrolysis | DSM N.V. (NL) | 1993-09-28 | — | — | US | disclosed |
| EP-0494716-A2 | Enzyme-catalysed preparation of optically active carboxylic acids | DSM N.V. (NL) | 1992-07-15 | — | — | EP | disclosed |