Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | WRN | Q14191 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.34 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.34 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.34 |
| ▸ | PRKCA | P17252 | 5/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | ELANE | P08246 | 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 | |
|---|---|---|---|---|
| SCHEMBL8220668 | 0.75 | POLB (0.42) | ALDH1A1PRKCA | |
| SCHEMBL1333553 | 0.75 | POLB (0.42) | ALDH1A1PRKCA | |
| SCHEMBL52102 | 0.75 | POLB (0.42) | ALDH1A1PRKCA | |
| SCHEMBL7893349 | 0.75 | POLB (0.42) | ALDH1A1PRKCA | |
| SCHEMBL2480467 | 0.75 | POLB (0.42) | ALDH1A1PRKCA | |
| SCHEMBL2242442 | 0.74 | ALDH1A1 (0.38) | ALDH1A1CYP1A2HPGDCYP2C19BLM | |
| SCHEMBL2241647 | 0.72 | ALDH1A1 (0.41) | ALDH1A1CYP1A2HPGDCYP2C19BLM | |
| SCHEMBL1690997 | 0.70 | ELANE (0.31) | ELANE | |
| SCHEMBL28972729 | 0.69 | PRKCA (0.38) | ALDH1A1CYP1A2HPGDCYP2C19BLM | |
| SCHEMBL12858644 | 0.68 | ALDH1A1 (0.41) | ALDH1A1CYP1A2HPGDCYP2C19BLM |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5230802-A | Liquid ion exchanger of alkyl 2,3-bis(alkanoyloxy)butanediote and ion exchange process | PHILIP MORRIS INCORPORATED (US) | 1993-07-27 | — | — | US | disclosed |
| EP-0514201-A1 | Separation process using organic acids and novel organic acids | Philip Morris Products Inc. (US) | 1992-11-19 | — | — | EP | disclosed |