Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 6/20 | 0.42 |
| ▸ | FABP1 | P07148 | 1/20 | 0.41 |
| ▸ | GALR3 | O60755 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | RAF1 | P04049 | 4/20 | 0.40 |
| ▸ | BRAF | P15056 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | AURKA | O14965 | 1/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | LCK | P06239 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.38 |
| ▸ | LYN | P07948 | 1/20 | 0.38 |
| ▸ | RET | P07949 | 1/20 | 0.38 |
| ▸ | ROS1 | P08922 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9098846 | 0.88 | KDR (0.49) | KDRRAF1BRAFPLK4AURKA | |
| SCHEMBL5724635 | 0.88 | KDR (0.53) | KDRRAB9ARAF1BRAFPLK4 | |
| SCHEMBL9100193 | 0.87 | CDK8 (0.42) | KDRMAPK1RAF1BRAFPLK4 | |
| SCHEMBL4473424 | 0.87 | KDR (0.54) | KDRRAF1BRAFPLK4AURKA | |
| SCHEMBL9102040 | 0.86 | CDK8 (0.45) | KDRRAB9ATP53RETMAPT | |
| SCHEMBL9105151 | 0.85 | RAF1 (0.50) | KDRMAPK1RAB9ARAF1BRAF | |
| SCHEMBL9101755 | 0.85 | RET (0.55) | KDRMAPK1RAF1BRAFPLK4 | |
| SCHEMBL9102011 | 0.82 | KDR (0.49) | KDRRAF1BRAFHIPK4 | |
| SCHEMBL9104786 | 0.82 | RAF1 (0.49) | KDRMAPK1RAF1BRAFPLK4 | |
| SCHEMBL9100015 | 0.81 | KDR (0.38) | KDRRAB9ARAF1BRAFPLK4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | claimed |
| EP-1685125-B1 | Pyrrole derivatives useful for the treatment of proliferative diseases | MERCK PATENT GMBH (DE) | 2012-06-06 | — | — | EP | disclosed |