Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 1/20 | 0.52 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.50 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.50 |
| ▸ | TAS1R2 | Q8TE23 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | TOP1 | P11387 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL2088326 | 0.85 | RAF1 (0.53) | RAF1TAS1R3TAS1R1TAS1R2LMNA | |
| SCHEMBL2088329 | 0.85 | RAF1 (0.53) | RAF1TAS1R3TAS1R1TAS1R2CYP1A2 | |
| SCHEMBL2093882 | 0.85 | RAF1 (0.53) | RAF1TAS1R3TAS1R1TAS1R2LMNA | |
| SCHEMBL2013991 | 0.83 | KMT2A (0.62) | RAF1TAS1R3TAS1R1TAS1R2LMNA | |
| SCHEMBL14053368 | 0.83 | RAF1 (0.46) | RAF1TAS1R3TAS1R1TAS1R2CYP1A2 | |
| SCHEMBL881514 | 0.83 | RAF1 (0.49) | RAF1TAS1R3TAS1R1TAS1R2LMNA | |
| SCHEMBL2093879 | 0.82 | RAF1 (0.51) | RAF1TAS1R3TAS1R1TAS1R2LMNA | |
| SCHEMBL8493065 | 0.81 | ALDH1A1 (0.59) | LMNAALDH1A1KDM4EGAAKMT2A | |
| SCHEMBL7759446 | 0.80 | TAS1R3 (0.50) | TAS1R3TAS1R1TAS1R2ALDH1A1KDM4E | |
| SCHEMBL7603112 | 0.80 | KMT2A (0.54) | RAF1TAS1R3TAS1R1TAS1R2LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0896531-A4 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2002-10-30 | — | — | EP | disclosed |
| EP-0896531-A1 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1999-02-17 | — | — | EP | disclosed |
| WO-1997029743-A1 | IL-8 RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-08-21 | — | — | WO | disclosed |