Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | S1PR1 | P21453 | 6/20 | 0.36 |
| ▸ | DVL1 | O14640 | 1/20 | 0.36 |
| ▸ | SLC22A12 | Q96S37 | 2/20 | 0.34 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.34 |
| ▸ | SCD | O00767 | 4/20 | 0.33 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | F10 | P00742 | 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 | |
|---|---|---|---|---|
| SCHEMBL9053560 | 0.90 | ALOX15 (0.38) | ALOX15S1PR1DVL1SCDPIM2 | |
| SCHEMBL7282936 | 0.69 | S1PR1 (0.46) | S1PR1SLC22A12FFAR4FFAR1KDM4E | |
| SCHEMBL7274869 | 0.68 | ITGB3 (0.57) | S1PR1F10 | |
| Hydrochloric Acid SCHEMBL9054174 | 0.66 | DVL1 (0.43) | ALOX15DVL1PIM2FFAR4FFAR1 | |
| Hydrochloric Acid SCHEMBL7394308 | 0.65 | ITGB3 (0.43) | S1PR1 | |
| SCHEMBL8559863 | 0.65 | S1PR1 (0.50) | S1PR1FFAR1ALDH1A1 | |
| SCHEMBL7274574 | 0.64 | ITGB3 (0.57) | S1PR1F10 | |
| Hydrochloric Acid SCHEMBL8563445 | 0.64 | S1PR1 (0.49) | S1PR1FFAR1ALDH1A1 | |
| SCHEMBL8559326 | 0.62 | S1PR1 (0.47) | S1PR1ALDH1A1F10 | |
| SCHEMBL3300620 | 0.61 | F10 (0.40) | KDM4EALDH1A1MAPTF10 |
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 |