Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 3/20 | 0.40 |
| ▸ | WNT3A | P56704 | 3/20 | 0.40 |
| ▸ | MMP2 | P08253 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | USP5 | P45974 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9470518 | 0.85 | HSD17B3 (0.44) | KMT2ARAB9ASMN1; SMN2ALDH1A1HPGD | |
| SCHEMBL9483493 | 0.73 | CYP1A2 (0.51) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL9683724 | 0.71 | ALDH1A1 (0.69) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL10353454 | 0.69 | NR4A2 (0.81) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL9470246 | 0.67 | MAP2K1 (0.47) | CYP1A2TSHRALDH1A1CYP2C19HPGD | |
| SCHEMBL1827517 | 0.67 | PDE4B (0.46) | KMT2APKMRAB9ACTNNB1WNT3A | |
| SCHEMBL8532083 | 0.67 | L3MBTL1 (0.65) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL5378003 | 0.66 | CTNNB1 (0.63) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL9365461 | 0.65 | GAA (0.57) | CYP1A2KMT2APKMTSHRNR4A2 | |
| SCHEMBL30309808 | 0.65 | GAA (0.57) | CYP1A2KMT2APKMTSHRNR4A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5246951-A | Nonsteroidal antiinflammatory agents | ADIR ET COMPAGNIE (FR) | 1993-09-21 | — | — | US | disclosed |