Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | DRD3 | P35462 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | DRD4 | P21917 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11301538 | 0.85 | CHRM2 (0.55) | CES1BLMCYP2D6KDM4EPOLB | |
| SCHEMBL9860776 | 0.84 | CES1 (0.64) | CES1BLMCYP2D6KDM4ECHRM2 | |
| SCHEMBL8466636 | 0.82 | CYP2D6 (0.46) | CES1BLMCYP2D6KDM4EPOLB | |
| SCHEMBL3266492 | 0.81 | CES1 (0.65) | CES1KDM4EPOLBALDH1A1SMN1; SMN2 | |
| SCHEMBL11171387 | 0.80 | CES1 (0.58) | CES1ALDH1A1 | |
| SCHEMBL11937422 | 0.80 | CYP2D6 (0.49) | CES1BLMCYP2D6KDM4EPOLB | |
| SCHEMBL3272321 | 0.80 | CES1 (0.57) | CES1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL11080785 | 0.80 | CES1 (0.57) | CES1KDM4EPOLBCHRM2CHRM1 | |
| SCHEMBL9065321 | 0.79 | CES1 (0.66) | CES1CYP2D6POLBALDH1A1SMN1; SMN2 | |
| SCHEMBL36702 | 0.79 | CES1 (0.66) | CES1CYP2D6POLBALDH1A1SMN1; SMN2 |
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-0002707-B1 | NEW AMINOALKYL-BENZILKETALS AND THEIR USE AS INITIATORS FOR THE POLYMERISATION OF UNSATURATED COMPOUNDS | CIBA-GEIGY AG (CH) | 1982-04-07 | — | — | EP | disclosed |
| US-4271294-A | PHOTOINITIATORS | CIBA-GEIGY CORPORATION (US) | 1981-06-02 | — | — | US | disclosed |
| EP-0002707-A1 | New aminoalkyl-benzilketals and their use as initiators for the polymerisation of unsaturated compounds | CIBA-GEIGY AG (CH) | 1979-07-11 | — | — | EP | disclosed |