Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.70 |
| ▸ | CCR1 | P32246 | 1/20 | 0.67 |
| ▸ | FERMT2 | Q96AC1 | 4/20 | 0.64 |
| ▸ | HTR1A | P08908 | 2/20 | 0.62 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.62 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.62 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.62 |
| ▸ | CCNC | P24863 | 1/20 | 0.62 |
| ▸ | CDK8 | P49336 | 1/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | HTT | P42858 | 1/20 | 0.60 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.60 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL7500391 | 0.92 | CYP1A2 (0.78) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL19160656 | 0.90 | CCNC (0.77) | CYP1A2CCR1FERMT2HTR1AADRA1D | |
| SCHEMBL31020168 | 0.87 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL21855417 | 0.87 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7503073 | 0.87 | CCNC (0.81) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7501744 | 0.86 | CYP1A2 (0.65) | CYP1A2CCR1FERMT2HTR1AADRA1D | |
| SCHEMBL12711196 | 0.86 | HTR1A (0.61) | CYP1A2CCR1FERMT2HTR1AADRA1D | |
| SCHEMBL7507732 | 0.85 | HTR1A (0.70) | CYP1A2CCR1FERMT2HTR1AADRA1D | |
| SCHEMBL7504559 | 0.85 | CYP1A2 (0.70) | CYP1A2CCR1FERMT2CCNCCDK8 | |
| SCHEMBL7502923 | 0.84 | CCR1 (0.79) | CYP1A2CCR1FERMT2KDM4ELMNA |
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-0326331-B1 | Substituted quinolines and cinnolines | DOW AGROSCIENCES LLC (US) | 2002-04-17 | — | — | EP | disclosed |