Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | LIMK1 | P53667 | 4/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | GCGR | P47871 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | USP7 | Q93009 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | HTR5A | P47898 | 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 | |
|---|---|---|---|---|
| SCHEMBL28788627 | 0.86 | CYP2A6 (0.52) | CYP2A6LIMK1MAOBDHODHMAPK14 | |
| SCHEMBL27613209 | 0.81 | ALDH1A1 (0.46) | MAPK14 | |
| SCHEMBL27717694 | 0.80 | CSNK2A1 (0.46) | CYP2A6 | |
| SCHEMBL8260133 | 0.77 | ALDH1A1 (0.48) | IDO1 | |
| SCHEMBL29964468 | 0.77 | MAPT (0.50) | LIMK1TNIKIDO1 | |
| SCHEMBL4433057 | 0.76 | CYP2A6 (0.58) | CYP2A6MAOBDHODHUSP7TAAR1 | |
| SCHEMBL19229354 | 0.75 | LIMK1 (0.40) | LIMK1IDO1 | |
| SCHEMBL1924747 | 0.74 | MAPT (0.57) | TNIKIDO1 | |
| SCHEMBL29313004 | 0.73 | ALDH1A1 (0.39) | CNR2HTR2AHTR2CHTR2B | |
| SCHEMBL1926646 | 0.73 | HIF1A (0.56) | CNR2MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101296906-A | (hetero)aryl compounds with MCH antagonistic activity and medicaments comprising these compounds | BOEHRINGER INGELHEIM INT (DE) | 2008-10-29 | — | — | CN | disclosed |