Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.41 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.37 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16632474 | 0.95 | SLC6A2 (0.41) | SLC6A2SLC6A4SLC6A3CFTRGOPC | |
| SCHEMBL16632830 | 0.88 | IDO1 (0.44) | SLC6A2SLC6A4SLC6A3CFTRGOPC | |
| SCHEMBL4088437 | 0.84 | TAAR1 (0.33) | SLC6A2SLC6A4SLC6A3TAAR1IDO1 | |
| Diethylamine SCHEMBL10776339 | 0.80 | HTT (0.40) | SLC6A2SLC6A4SLC6A3L3MBTL1KMT2A | |
| SCHEMBL10779981 | 0.79 | MEN1 (0.44) | GAAKMT2ATDP1HDAC8HDAC6 | |
| SCHEMBL28888535 | 0.78 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3CFTRGOPC | |
| SCHEMBL10778821 | 0.76 | HPGD (0.53) | SLC6A2TSHRALDH1A1GAAL3MBTL1 | |
| SCHEMBL30986671 | 0.76 | MEN1 (0.48) | SLC6A2SLC6A4SLC6A3TSHRGAA | |
| SCHEMBL13714106 | 0.76 | MEN1 (0.48) | SLC6A2SLC6A4SLC6A3TSHRGAA | |
| SCHEMBL8318669 | 0.76 | TYR (0.46) | ALDH1A1KMT2ATAAR1CYP2C9CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9815694-B2 | Catalytic ammonia synthesis by transition metal molecular complexes | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2017-11-14 | — | — | US | disclosed |
| US-20150104371-A1 | CATALYTIC AMMONIA SYNTHESIS BY TRANSITION METAL MOLECULAR COMPLEXES | CALIFORNIA INSTITUTE OF TECHNOLOGY | 2015-04-16 | — | — | US | disclosed |