Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10880203 | 0.77 | CYP1A2 (0.48) | CYP1A2CYP2D6MAPTKMT2AALDH1A1 | |
| SCHEMBL3150010 | 0.71 | SLC22A12 (0.50) | FFAR1ALDH1A1HPGD | |
| SCHEMBL21253178 | 0.71 | CYP1A2 (0.46) | CYP1A2FFAR1MAPTKMT2AALDH1A1 | |
| SCHEMBL15114537 | 0.71 | CES1 (0.41) | CYP1A2FFAR1MAPTALDH1A1TSHR | |
| SCHEMBL28846242 | 0.69 | MAPT (0.43) | CYP1A2FFAR1MAPTALDH1A1TSHR | |
| SCHEMBL11270832 | 0.69 | KIF11 (0.43) | MAPTALDH1A1TSHRKCNN4HPGD | |
| SCHEMBL11208198 | 0.68 | ALDH1A1 (0.47) | FFAR1MAPTKMT2AALDH1A1TSHR | |
| SCHEMBL7074813 | 0.68 | CES1 (0.44) | CYP1A2FFAR1MAPTALDH1A1TSHR | |
| SCHEMBL11264686 | 0.68 | ALDH1A1 (0.42) | CYP1A2FFAR1CYP2D6MAPTKMT2A | |
| SCHEMBL5552914 | 0.68 | POLB (0.44) | CYP1A2FFAR1MAPTKMT2AALDH1A1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0161932-B1 | PREPARATION OF CARBOXYPHENYLTHIOPHENYLACETIC ACIDS | MERCK & CO. INC. (US) | 1988-04-13 | — | — | EP | claimed |
| EP-0161932-A2 | Preparation of carboxyphenylthiophenylacetic acids | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | claimed |
| EP-0161932-B1 | PREPARATION OF CARBOXYPHENYLTHIOPHENYLACETIC ACIDS | MERCK & CO. INC. (US) | 1988-04-13 | — | — | EP | disclosed |
| EP-0161932-A2 | Preparation of carboxyphenylthiophenylacetic acids | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0161932-A2 | Preparation of carboxyphenylthiophenylacetic acids | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | disclosed |
| EP-0161932-A2 | Preparation of carboxyphenylthiophenylacetic acids | MERCK & CO. INC. (US) | 1985-11-21 | — | — | EP | disclosed |