Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.41 |
| ▸ | EGFR | P00533 | 2/20 | 0.41 |
| ▸ | KDR | P35968 | 2/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | UBE2N | P61088 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5805083 | 0.91 | EGFR (0.47) | CHEK1EGFRKDRMAPTUBE2N | |
| SCHEMBL5804950 | 0.86 | KDR (0.42) | CHEK1EGFRKDRNR1H4MAPT | |
| SCHEMBL4169210 | 0.86 | HMGCR (0.47) | CHEK1EGFRKDRNR1H4MAPT | |
| SCHEMBL5807727 | 0.85 | HMGCR (0.46) | CHEK1EGFRKDRNR1H4MAPT | |
| SCHEMBL5804872 | 0.84 | RAB9A (0.46) | KCNK9TRPV1CNR1GAARAB9A | |
| SCHEMBL5805311 | 0.84 | HTT (0.45) | CHEK1EGFRKDRMAPTUBE2N | |
| SCHEMBL5808861 | 0.84 | HTT (0.45) | CHEK1EGFRKDRMAPTUBE2N | |
| SCHEMBL5809279 | 0.83 | MAPT (0.49) | CHEK1EGFRKDRMAPTUBE2N | |
| SCHEMBL5806885 | 0.81 | CHEK1 (0.42) | CHEK1EGFRKDRCNR1MAPT | |
| SCHEMBL5806553 | 0.81 | HMGCR (0.43) | CHEK1EGFRKDRNR1H4MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006110918-A1 | PYRROLE COMPOUNDS AND USES THEREOF | AMBIT BIOSCIENCES CORPORATION (US) | 2006-10-19 | — | — | WO | claimed |
| US-7323490-B2 | Pyrrole compounds and uses thereof | AMBIT BIOSCIENCES CORPORATION (US) | 2008-01-29 | — | — | US | disclosed |
| WO-2006110918-A1 | PYRROLE COMPOUNDS AND USES THEREOF | AMBIT BIOSCIENCES CORPORATION (US) | 2006-10-19 | — | — | WO | disclosed |