Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.45 |
| ▸ | TPSD1 | Q9BZJ3 | 2/20 | 0.45 |
| ▸ | TPSG1 | Q9NRR2 | 2/20 | 0.45 |
| ▸ | NAAA | Q02083 | 1/20 | 0.44 |
| ▸ | PREP | P48147 | 4/20 | 0.44 |
| ▸ | ACE | P12821 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9774258 | 0.88 | ACE (0.53) | PREPACECYP3A4ALOX15MEN1 | |
| SCHEMBL10464194 | 0.87 | CYP1A2 (0.44) | CYP1A2TPSAB1TPSD1TPSG1NAAA | |
| SCHEMBL9773813 | 0.85 | ACE (0.55) | PREPACECYP3A4ALOX15MEN1 | |
| SCHEMBL9774174 | 0.84 | ACE (0.52) | PREPACECYP3A4ALOX15MEN1 | |
| SCHEMBL9775263 | 0.82 | NAAA (0.39) | CYP1A2NAAAACECYP3A4ALOX15 | |
| SCHEMBL9775229 | 0.82 | SMN1; SMN2 (0.45) | PREPACE | |
| SCHEMBL9774278 | 0.81 | ACE (0.54) | PREPACECYP3A4ALOX15MEN1 | |
| SCHEMBL10437302 | 0.80 | CYP1A2 (0.42) | CYP1A2TPSAB1TPSD1TPSG1NAAA | |
| SCHEMBL9774299 | 0.78 | PREP (0.47) | PREPACECYP3A4ALOX15MEN1 | |
| SCHEMBL9775243 | 0.77 | EPHX1 (0.51) | PREPACECYP3A4ALOX15MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5068242-A | PYRROLIDINE-2-CARBOXYLIC ACID DERIVATIVES AND THEIR USE FOR PSYCHOTROPIC ACTION | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-11-26 | — | — | US | disclosed |