Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.42 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL27545283 | 0.84 | SMN1; SMN2 (0.39) | ALDH1A1GAAMAPTKCNH2 | |
| SCHEMBL621779 | 0.80 | HTR1A (0.58) | IDO1TAAR1ABCB1HTR1AADRA1D | |
| SCHEMBL27588489 | 0.79 | IDO1 (0.46) | IDO1TAAR1CHRM2CHRM1ALDH1A1 | |
| SCHEMBL1584610 | 0.79 | TAAR1 (0.39) | TAAR1CHRM2LTA4HALDH1A1MEN1 | |
| SCHEMBL8859966 | 0.78 | HTR1A (0.43) | HTR1AADRA1DADRA1AADRA1BLTA4H | |
| SCHEMBL28319772 | 0.75 | TUBB4A (0.50) | — | |
| SCHEMBL3296809 | 0.75 | IDO1 (0.61) | IDO1TAAR1CHRM2CHRM1ALDH1A1 | |
| SCHEMBL28752782 | 0.74 | IDO1 (0.45) | IDO1TAAR1CHRM2CHRM1LTA4H | |
| SCHEMBL920242 | 0.74 | IDO1 (0.49) | IDO1TAAR1ABCB1HTR1AADRA1D | |
| SCHEMBL9283523 | 0.74 | CYP1A2 (0.37) | ALDH1A1GAAMEN1KMT2A |
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-5654309-A | KIDNEY, CARDIOVASCULAR AND RESPIRATORY SYSTEM DISORDERS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1997-08-05 | — | — | US | disclosed |