Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GALR3 | O60755 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL16054768 | 0.86 | KMT2A (0.53) | MAPK1USP2CYP3A4ALDH1A1TP53 | |
| SCHEMBL17863579 | 0.84 | ALDH1A1 (0.48) | MAPK1CYP3A4ALDH1A1NPSR1TSHR | |
| SCHEMBL10516365 | 0.82 | CYP19A1 (0.54) | MAPK1USP2CYP3A4ALDH1A1CYP19A1 | |
| SCHEMBL486678 | 0.78 | ALDH1A1 (0.63) | MAPK1CYP3A4ALDH1A1KMT2ATSHR | |
| SCHEMBL11130696 | 0.77 | ALDH1A1 (0.49) | MAPK1USP2CYP3A4ALDH1A1CYP19A1 | |
| SCHEMBL17072863 | 0.77 | ALDH1A1 (0.53) | MAPK1CYP3A4ALDH1A1CYP19A1CYP17A1 | |
| SCHEMBL14798131 | 0.77 | ALDH1A1 (0.61) | MAPK1CYP3A4ALDH1A1KMT2ATSHR | |
| SCHEMBL27601383 | 0.77 | ALDH1A1 (0.43) | MAPK1CYP3A4ALDH1A1KMT2AHTT | |
| SCHEMBL5083630 | 0.77 | LMNA (0.48) | MAPK1CYP3A4ALDH1A1TSHRHSD17B10 | |
| SCHEMBL11809690 | 0.77 | ESR1 (0.44) | CYP3A4ALDH1A1CYP2C19KMT2ANPSR1 |
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-0480279-A1 | Process for the preparation of pyridineacylals | BASF Aktiengesellschaft (DE) | 1992-04-15 | — | — | EP | disclosed |