Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL18386524 | 0.81 | — | — | |
| SCHEMBL15274410 | 0.75 | CYP2C9 (0.44) | CYP2C9TAAR1CYP2C19ADRA1DMAPT | |
| SCHEMBL9413098 | 0.73 | CYP2C9 (0.45) | CYP2C9TAAR1CYP2C19ADRA1DHSD17B10 | |
| SCHEMBL2065835 | 0.72 | — | — | |
| SCHEMBL7457520 | 0.72 | KMT2A (0.38) | CYP2C9TAAR1CYP2C19KMT2AALDH1A1 | |
| SCHEMBL30505689 | 0.72 | CYP2C9 (0.50) | CYP2C9TAAR1CYP2C19ADRA1DPOLB | |
| SCHEMBL1491977 | 0.71 | — | — | |
| SCHEMBL3716800 | 0.71 | — | — | |
| SCHEMBL255742 | 0.71 | — | — | |
| SCHEMBL9632650 | 0.71 | — | — |
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-0585999-A1 | Functional heteroaromatics for NLO applications | ENICHEM S.p.A. (IT) | 1994-03-09 | — | — | EP | disclosed |