Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.64 |
| ▸ | GAA | P10253 | 1/20 | 0.64 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.36 |
| ▸ | RAD52 | P43351 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 3/20 | 0.34 |
| ▸ | LTB4R2 | Q9NPC1 | 3/20 | 0.34 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 1/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.32 |
| ▸ | APP | P05067 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9455878 | 0.77 | ALDH1A1 (0.62) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL27556380 | 0.76 | ALDH1A1 (0.38) | ALDH1A1GAARAD52KDM4EHPGD | |
| SCHEMBL1151568 | 0.74 | ALDH1A1 (0.59) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL27531474 | 0.73 | ALDH1A1 (0.55) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL9456183 | 0.73 | ALDH1A1 (0.51) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL8004072 | 0.72 | ALDH1A1 (0.54) | ALDH1A1GAAABCB1KDM4EMRGPRX4 | |
| SCHEMBL941425 | 0.71 | ALDH1A1 (0.46) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL7846530 | 0.71 | ALDH1A1 (0.52) | ALDH1A1GAAABCB1KDM4EHPGD | |
| SCHEMBL29085441 | 0.70 | ALDH1A1 (0.47) | ALDH1A1RAD52ELANE | |
| SCHEMBL7812602 | 0.70 | ALDH1A1 (0.50) | ALDH1A1GAAABCB1KDM4EHPGD |
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-2001079209-A2 | DIAZAFLUORENONE IL-8 ANTAGONISTS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2001-10-25 | — | — | WO | disclosed |