Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 1/20 | 0.59 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.59 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 3/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | GRIK1 | P39086 | 6/20 | 0.55 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5594890 | 1.00 | KDR (0.59) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL22025444 | 0.86 | KMT2A (0.68) | KDRMEN1KMT2AMAPTHTT | |
| SCHEMBL1463622 | 0.84 | TRPV1 (0.70) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL7486971 | 0.82 | KDR (0.50) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL1463419 | 0.81 | NTRK1 (0.81) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL8370705 | 0.81 | KDR (0.63) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL5594895 | 0.81 | CHRNA7 (0.61) | KDRMEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL5595253 | 0.81 | CHRNA7 (0.61) | KDRMEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL1463349 | 0.81 | GSK3A (0.66) | KDRNTRK1CDK19MEN1KMT2A | |
| SCHEMBL1463167 | 0.81 | KDR (0.73) | KDRNTRK1CDK19MEN1KMT2A |
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 |