Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 6/20 | 0.40 |
| ▸ | TLR2 | O60603 | 1/20 | 0.39 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.39 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.39 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | PRKDC | P78527 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | FDPS | P14324 | 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 | |
|---|---|---|---|---|
| SCHEMBL14242951 | 0.83 | ALDH1A1 (0.50) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL7614307 | 0.82 | ALDH1A1 (0.48) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL16233094 | 0.80 | ALDH1A1 (0.53) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL3856515 | 0.80 | L3MBTL1 (0.46) | KDM4ETSHRL3MBTL1MEN1KMT2A | |
| SCHEMBL14243152 | 0.79 | ALDH1A1 (0.46) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL15059172 | 0.78 | CYP19A1 (0.50) | — | |
| SCHEMBL31738417 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL4186655 | 0.78 | ALDH1A1 (0.52) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL7137868 | 0.78 | ALDH1A1 (0.44) | ALDH1A1KDM4ETSHRTDP1TUBB1 | |
| SCHEMBL1186123 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4ETSHRTDP1TUBB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2004050080-A1 | TREATMENT OF INFLAMMATORY DISORDERS WITH 2,3-BENZODIAZEPINES | VELA PHARMACEUTICALS, INC. (US) | 2004-06-17 | — | — | WO | disclosed |
| WO-2004050616-A2 | TREATMENT OF IRRITABLE BOWEL SYNDROME AND NONULCER DYSPEPSIA WITH SUBSTITUTED 2,3-BENZODIAZEPINES | VELA PHARMACEUTICALS, INC. (US) | 2004-06-17 | — | — | WO | disclosed |