Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.45 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | GAA | P10253 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.42 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | RGS12 | O14924 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11143386 | 0.90 | AKR1B1 (0.55) | AKR1B1TDP1PLA2G10PLA2G2AHPGD | |
| SCHEMBL4557746 | 0.82 | AKR1B1 (0.64) | AKR1B1TDP1PLA2G10PLA2G2AHPGD | |
| SCHEMBL8701316 | 0.82 | TSHR (0.57) | AKR1B1PLA2G10PLA2G2ATSHRPTPN1 | |
| SCHEMBL1401775 | 0.80 | AKR1B1 (0.60) | AKR1B1TDP1HPGDALDH1A1CYP1A2 | |
| SCHEMBL70565 | 0.80 | AKR1B1 (0.71) | AKR1B1TDP1HPGDALDH1A1CYP1A2 | |
| SCHEMBL8066546 | 0.78 | AKR1B1 (0.46) | AKR1B1PLA2G10PLA2G2ACYP1A2CYP2C19 | |
| SCHEMBL9566274 | 0.78 | AKR1B1 (0.57) | AKR1B1TDP1HPGDALDH1A1CYP1A2 | |
| SCHEMBL1773099 | 0.78 | HTR2A (0.56) | TDP1HPGDALDH1A1LMNAGAA | |
| Hydrochloric Acid SCHEMBL8922940 | 0.78 | AKR1B1 (0.68) | AKR1B1TDP1HPGDALDH1A1CYP1A2 | |
| Acetic Acid SCHEMBL9783357 | 0.77 | AKR1B1 (0.57) | AKR1B1TDP1PLA2G10PLA2G2AHPGD |
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-0536713-A1 | Oxazole and imidazole derivatives as prostaglandin analogs | E.R. SQUIBB & SONS, INC. (US) | 1993-04-14 | — | — | EP | disclosed |