Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC1A3 | P43003 | 3/20 | 0.57 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.57 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.37 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2015332 | 1.00 | SLC1A3 (0.57) | SLC1A3SLC1A2SLC1A1GAAHTT | |
| SCHEMBL7697914 | 0.82 | FOLH1 (0.60) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL9115232 | 0.81 | SLC1A3 (0.64) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL7094101 | 0.80 | SLC1A3 (0.57) | SLC1A3SLC1A2SLC1A1ADRA1ASLC7A5 | |
| SCHEMBL20548024 | 0.80 | SLC1A3 (0.57) | SLC1A3SLC1A2SLC1A1ADRA1ASLC7A5 | |
| SCHEMBL27809820 | 0.80 | CHRM1 (0.65) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL21017198 | 0.80 | CHRM1 (0.65) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL14312525 | 0.77 | GABRR1 (0.44) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL2484602 | 0.77 | FOLH1 (0.43) | SLC1A3SLC1A2SLC1A1FOLH1CHRM1 | |
| SCHEMBL5378219 | 0.77 | SLC1A3 (0.61) | SLC1A3SLC1A2SLC1A1CHRM1AKR1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2391600-B1 | INTERMEDIATES IN THE ENANTIOSELECTIVE SYNTHESIS OF 3-(AMINOMETHYL)-5-METHYL-HEXANOIC ACID | PROVOST FELLOWS & SCHOLARS COLLEGE OF THE HOLY UNDIVIDED TRINITY OF QUEEN ELIZABETH NEAR DUBLIN (IE) | 2016-01-06 | — | — | EP | disclosed |