Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.58 |
| ▸ | LMNA | P02545 | 6/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.58 |
| ▸ | TSHR | P16473 | 4/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | ESR1 | P03372 | 2/20 | 0.56 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.56 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.55 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.53 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.53 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.53 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 5/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL43781 | 1.00 | ALDH1A1 (0.58) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL29988943 | 1.00 | ALDH1A1 (0.58) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL30753139 | 0.96 | ALDH1A1 (0.54) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL22092111 | 0.95 | ALDH1A1 (0.59) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| Trolamine SCHEMBL29516438 | 0.91 | LMNA (0.50) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL357704 | 0.91 | LMNA (0.68) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL12380037 | 0.91 | ALDH1A1 (0.60) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL12380026 | 0.91 | ALDH1A1 (0.60) | ALDH1A1LMNACYP3A4HSD17B10TSHR | |
| SCHEMBL16278866 | 0.89 | ESR1 (0.69) | ALDH1A1LMNACYP3A4TSHRCYP1A2 | |
| SCHEMBL17797863 | 0.89 | ESR1 (0.69) | ALDH1A1LMNACYP3A4TSHRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0003872-A1 | Substituted benzoic acid esters, compositions containing them, combinations thereof with photoinitiators and methods of making cured plastics compositions using them | WARD BLENKINSOP AND COMPANY LIMITED (GB) | 1979-09-05 | — | — | EP | disclosed |