Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | F7 | P08709 | 2/20 | 0.41 |
| ▸ | F3 | P13726 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.41 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | PTGS1 | P23219 | 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 | |
|---|---|---|---|---|
| SCHEMBL27557979 | 0.87 | CNR1 (0.51) | ALDH1A1MAPTOXER1HPGD | |
| SCHEMBL9712213 | 0.82 | F7 (0.53) | ALDH1A1CYP3A4ALOX15HSD17B10TDP1 | |
| SCHEMBL1301820 | 0.82 | F7 (0.53) | ALDH1A1CYP3A4ALOX15HSD17B10TDP1 | |
| SCHEMBL11525734 | 0.81 | ALDH1A1 (0.59) | ALDH1A1CYP3A4TSHRMAPTLMNA | |
| SCHEMBL17249966 | 0.81 | ALDH1A1 (0.51) | ALDH1A1CYP3A4ALOX15HSD17B10TDP1 | |
| SCHEMBL22625515 | 0.80 | TERT (0.46) | ALOX15HSD17B10TDP1F7F3 | |
| SCHEMBL28851524 | 0.80 | ACE2 (0.52) | HSD17B10MEN1LMNAHPGDRECQL | |
| SCHEMBL28333296 | 0.80 | ACE2 (0.52) | HSD17B10MEN1LMNAHPGDRECQL | |
| SCHEMBL2254424 | 0.80 | ACE2 (0.52) | HSD17B10MEN1LMNAHPGDRECQL | |
| SCHEMBL16201901 | 0.80 | ACE2 (0.52) | HSD17B10MEN1LMNAHPGDRECQL |
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-0329124-A2 | Metabolites of pentanedioic acid derivatives | G.D. Searle & Co. (US) | 1989-08-23 | — | — | EP | disclosed |