Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.52 |
| ▸ | HTR2A | P28223 | 3/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.45 |
| ▸ | DPP4 | P27487 | 2/20 | 0.44 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.43 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4773075 | 0.76 | TAAR1 (0.56) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3640948 | 0.76 | DPP4 (0.62) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL28923019 | 0.76 | DPP4 (0.48) | TAAR1HTR2ADPP4F2HRH1 | |
| SCHEMBL25047231 | 0.76 | TAAR1 (0.50) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL29181172 | 0.76 | TAAR1 (0.50) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3676574 | 0.75 | DPP4 (0.52) | TAAR1HTR2ADPP4F2 | |
| SCHEMBL28548590 | 0.75 | DPP4 (0.52) | TAAR1HTR2ADPP4F2 | |
| SCHEMBL1667061 | 0.75 | GABBR2 (0.52) | — | |
| Hydrochloric Acid SCHEMBL28410804 | 0.74 | TAAR1 (0.54) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL14945067 | 0.74 | TAAR1 (0.61) | TAAR1HTR2ASLC6A2SLC6A4SLC6A3 |
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-102603635-B | Geldanamycin derivant and its production and use | 杭州华东医药集团生物工程研究所有限公司 | 2016-08-03 | — | — | CN | disclosed |