Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 3/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TYR | P14679 | 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 | |
|---|---|---|---|---|
| SCHEMBL16632444 | 0.87 | GABRA1 (0.36) | SLC6A2SLC6A4SLC6A3TAAR1LMNA | |
| SCHEMBL16640280 | 0.78 | ESR1 (0.42) | SLC6A2SLC6A4SLC6A3ADRA2AADRA2C | |
| SCHEMBL16640269 | 0.78 | GABRA1 (0.30) | — | |
| SCHEMBL16640275 | 0.78 | ESR1 (0.42) | SLC6A2SLC6A4SLC6A3ADRA2AADRA2C | |
| SCHEMBL2847943 | 0.77 | SLC6A2 (0.35) | SLC6A2SLC6A4SLC6A3TAAR1ADRA2A | |
| SCHEMBL10643591 | 0.77 | SLC6A2 (0.37) | SLC6A2SLC6A4SLC6A3MEN1MAPT | |
| SCHEMBL18605828 | 0.77 | GABRA1 (0.32) | — | |
| SCHEMBL18280246 | 0.77 | GABRA1 (0.32) | — | |
| SCHEMBL30096500 | 0.77 | TAAR1 (0.35) | SLC6A2SLC6A4SLC6A3TAAR1CYP2D6 | |
| SCHEMBL4453279 | 0.77 | TAAR1 (0.35) | SLC6A2SLC6A4SLC6A3TAAR1CYP2D6 |
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 |