Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.44 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24001256 | 1.00 | ALDH1A1 (0.50) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| SCHEMBL27065452 | 0.98 | ALDH1A1 (0.48) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| SCHEMBL7418522 | 0.98 | CYP1A2 (0.50) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| Hydrochloric Acid SCHEMBL7418518 | 0.97 | ALDH1A1 (0.50) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| SCHEMBL24757426 | 0.97 | CYP1A2 (0.48) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| SCHEMBL24757440 | 0.93 | CYP1A2 (0.48) | ALDH1A1HRH3L3MBTL1MAPTALOX15 | |
| SCHEMBL856060 | 0.93 | CYP1A2 (0.56) | ALDH1A1HRH3L3MBTL1MAPTCYP1A2 | |
| SCHEMBL1863035 | 0.93 | CYP1A2 (0.56) | ALDH1A1HRH3L3MBTL1MAPTCYP1A2 | |
| Bromide SCHEMBL741360 | 0.92 | CYP1A2 (0.55) | ALDH1A1HRH3L3MBTL1MAPTCYP1A2 | |
| SCHEMBL1855324 | 0.91 | CYP1A2 (0.53) | ALDH1A1HRH3L3MBTL1MAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021225968-A1 | LUMINALLY-ACTING N-(PIPERIDIN-4-YL)BENZAMIDE DERIVATIVES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2021-11-11 | — | — | WO | disclosed |