Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR2 | P25025 | 4/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.36 |
| ▸ | RPS6KA5 | O75582 | 2/20 | 0.36 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.36 |
| ▸ | PRKACA | P17612 | 2/20 | 0.36 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.36 |
| ▸ | AKT1 | P31749 | 2/20 | 0.36 |
| ▸ | AKT2 | P31751 | 2/20 | 0.36 |
| ▸ | GSK3A | P49840 | 2/20 | 0.36 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 2/20 | 0.36 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | PRKG1 | Q13976 | 2/20 | 0.36 |
| ▸ | PKN2 | Q16513 | 2/20 | 0.36 |
| ▸ | CDC42BPA | Q5VT25 | 2/20 | 0.36 |
| ▸ | HIPK4 | Q8NE63 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7894173 | 0.83 | LOXL2 (0.44) | CHEK1CHEK2PRKACARPS6KB1AKT1 | |
| SCHEMBL18235921 | 0.81 | HDAC6 (0.40) | HDAC1MLYCDHDAC7HDAC8HDAC6 | |
| SCHEMBL8666923 | 0.78 | CYP19A1 (0.32) | ABCC9ABCC8KCNJ11KCNJ8 | |
| SCHEMBL9091919 | 0.75 | CXCR2 (0.47) | CXCR2SLC22A12FLT4 | |
| SCHEMBL8371911 | 0.72 | ABCB1 (0.50) | CXCR2HDAC1HDAC8HDAC6ABCC9 | |
| SCHEMBL8769032 | 0.72 | MAPKAPK2 (0.65) | CXCR2HDAC1CHEK1DAPK3RPS6KA5 | |
| SCHEMBL8870499 | 0.69 | CXCR2 (0.47) | CXCR2CHEK2GSK3AGSK3BROCK1 | |
| SCHEMBL8373592 | 0.69 | ABCC9 (0.51) | CXCR2HDAC1CHEK1DAPK3CHEK2 | |
| SCHEMBL7347226 | 0.69 | PLK1 (0.67) | CXCR2CHEK1DAPK3CHEK2RPS6KB1 | |
| SCHEMBL8372683 | 0.69 | PLK1 (0.67) | CXCR2CHEK1DAPK3CHEK2RPS6KB1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0796243-B1 | DIAMINOCYCLOBUTENE-3,4-DIONES | AMERICAN HOME PROD (US) | 1999-01-27 | — | — | EP | disclosed |
| EP-0796243-A1 | DIAMINOCYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-09-24 | — | — | EP | disclosed |
| US-5536741-A | SMOOTH MUSCLE RELAXANTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-07-16 | — | — | US | disclosed |
| US-5536731-A | SMOOTH MUSCLE RELAXANTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-07-16 | — | — | US | disclosed |
| US-5530025-A | SMOOTH MUSCLE RELAXANTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-06-25 | — | — | US | disclosed |
| WO-1996015103-A1 | DIAMINOCYCLOBUTENE-3,4-DIONES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1996-05-23 | — | — | WO | disclosed |
| US-5464867-A | SMOOTH MUSCLE RELAXANTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1995-11-07 | — | — | US | disclosed |