Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.49 |
| ▸ | GPR52 | Q9Y2T5 | 3/20 | 0.48 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 2/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4431762 | 0.93 | TAAR1 (0.55) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL4431759 | 0.93 | TAAR1 (0.55) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL9011193 | 0.93 | TAAR1 (0.55) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL4635536 | 0.88 | TAAR1 (0.50) | TAAR1GPR52IDO1HRH3GPR84 | |
| P-Xylene SCHEMBL11767119 | 0.86 | CYP1A2 (0.48) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL105975 | 0.86 | CYP1A2 (0.48) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL713023 | 0.86 | CYP1A2 (0.48) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL30242341 | 0.83 | TAAR1 (0.52) | TAAR1GPR52IDO1HRH3GPR84 | |
| SCHEMBL4953940 | 0.82 | TAAR1 (0.63) | TAAR1IDO1HRH3GPR84KCNH2 | |
| SCHEMBL9010959 | 0.81 | GPR52 (0.44) | TAAR1GPR52IDO1HRH3GPR84 |
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-0554704-B1 | Process for producing dimethyl naphthalene | MITSUBISHI GAS CHEMICAL CO (JP) | 1996-11-13 | — | — | EP | claimed |