Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LIG1 | P18858 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.46 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29519569 | 0.94 | LIG1 (0.69) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL40310 | 0.94 | LIG1 (0.69) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL28253072 | 0.92 | LIG1 (0.67) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL8066010 | 0.92 | LIG1 (0.67) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL2788250 | 0.92 | LIG1 (0.67) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL7794511 | 0.92 | LIG1 (0.67) | LIG1TSHRGAAALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL7221224 | 0.92 | LIG1 (0.67) | LIG1TSHRGAAALDH1A1KMT2A | |
| Acetic Acid SCHEMBL28195889 | 0.88 | LIG1 (0.61) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL8922614 | 0.82 | LIG1 (0.56) | LIG1TSHRGAAALDH1A1KMT2A | |
| SCHEMBL9696302 | 0.82 | LIG1 (0.71) | LIG1TSHRGAAALDH1A1KMT2A |
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-5654471-A | Process for the preparation of 4-hydroxyphenyl benzoate derivatives | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1997-08-05 | — | — | US | disclosed |