Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | GRM7 | Q14831 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.32 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.32 |
| ▸ | DPP4 | P27487 | 2/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | HPGDS | O60760 | 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 | |
|---|---|---|---|---|
| SCHEMBL9268820 | 0.89 | SMN1; SMN2 (0.37) | RAB9AMTORGRM7TSHRCYP3A4 | |
| Hydrochloric Acid SCHEMBL26908778 | 0.79 | TAAR1 (0.38) | TSHRCYP3A4ALOX15SMN1; SMN2ALDH1A1 | |
| SCHEMBL10989198 | 0.78 | ADRA2C (0.41) | TSHRCYP3A4ALOX15MAPTKDM4E | |
| SCHEMBL2028407 | 0.76 | ALDH1A1 (0.46) | RAB9AMTORGRM7TSHRCYP3A4 | |
| Ammonia Solution, Strong SCHEMBL27951261 | 0.76 | HDAC1 (0.39) | RAB9AMTORGRM7TSHRCYP3A4 | |
| SCHEMBL9631266 | 0.76 | CYP3A4 (0.35) | RAB9AMTORGRM7TSHRCYP3A4 | |
| SCHEMBL9416672 | 0.76 | SMN1; SMN2 (0.35) | RAB9AMTORGRM7TSHRCYP3A4 | |
| SCHEMBL897649 | 0.76 | KDM4E (0.38) | RAB9AMTORGRM7TSHRCYP3A4 | |
| SCHEMBL1444029 | 0.76 | AOC3 (0.42) | TSHRCYP3A4ALOX15MAPTKDM4E | |
| SCHEMBL9631211 | 0.76 | ALDH1A1 (0.39) | RAB9AMTORGRM7TSHRCYP3A4 |
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-7732365-B2 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2010-06-08 | — | — | US | disclosed |
| US-7732365-B2 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2010-06-08 | — | — | US | disclosed |