Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 3/20 | 0.36 |
| ▸ | SCD | O00767 | 3/20 | 0.34 |
| ▸ | FFAR4 | Q5NUL3 | 4/20 | 0.34 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.34 |
| ▸ | DVL1 | O14640 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 2/20 | 0.32 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.32 |
| ▸ | USP28 | Q96RU2 | 2/20 | 0.32 |
| ▸ | USP25 | Q9UHP3 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9054444 | 0.90 | ALOX15 (0.39) | ALOX15S1PR1SCDFFAR4FFAR1 | |
| Hydrochloric Acid SCHEMBL8559613 | 0.69 | HTR6 (0.39) | S1PR1FFAR4FFAR1USP28USP25 | |
| SCHEMBL7283193 | 0.68 | ITGB3 (0.57) | — | |
| Hydrochloric Acid SCHEMBL9054174 | 0.66 | DVL1 (0.43) | ALOX15FFAR4FFAR1DVL1ROCK2 | |
| SCHEMBL8559863 | 0.64 | S1PR1 (0.50) | S1PR1FFAR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL8563445 | 0.63 | S1PR1 (0.49) | S1PR1FFAR1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL9059209 | 0.63 | ACHE (0.42) | MAPTKDM4EALDH1A1KMT2A | |
| SCHEMBL8559326 | 0.62 | S1PR1 (0.47) | S1PR1ALDH1A1 | |
| SCHEMBL22171283 | 0.61 | HTR2C (0.39) | FFAR4FFAR1USP28USP25ALDH1A1 | |
| SCHEMBL3300620 | 0.61 | F10 (0.40) | GRM5MAPTKDM4EALDH1A1 |
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-1996004271-A1 | CONDENSED AZEPINE DERIVATIVES, DRUGS CONTAINING THESE COMPOUNDS AND METHODS FOR PREPARING THEM | DR. KARL THOMAE GMBH (DE) | 1996-02-15 | — | — | WO | disclosed |