Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.50 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 6/20 | 0.44 |
| ▸ | KDR | P35968 | 5/20 | 0.44 |
| ▸ | FLT4 | P35916 | 4/20 | 0.44 |
| ▸ | FLT3 | P36888 | 4/20 | 0.44 |
| ▸ | PLK4 | O00444 | 3/20 | 0.44 |
| ▸ | AURKA | O14965 | 3/20 | 0.44 |
| ▸ | SRC | P12931 | 3/20 | 0.44 |
| ▸ | TEK | Q02763 | 3/20 | 0.44 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.44 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.44 |
| ▸ | NUAK1 | O60285 | 2/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | INSR | P06213 | 2/20 | 0.44 |
| ▸ | IGF1R | P08069 | 2/20 | 0.44 |
| ▸ | KIT | P10721 | 2/20 | 0.44 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
| ▸ | CCND1 | P24385 | 2/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30203585 | 0.75 | ERN1 (0.66) | SRCTLR2ERN1TLR1TLR6 | |
| SCHEMBL4482585 | 0.75 | ITK (0.51) | FLT3AURKACDK4CDK2TLR2 | |
| SCHEMBL27494000 | 0.75 | PDGFRB (0.51) | PDGFRBKDRFLT4FLT3PLK4 | |
| SCHEMBL8730331 | 0.75 | IMPDH2 (0.65) | CYP2A6IMPDH2PDGFRBKDRFLT3 | |
| SCHEMBL19608967 | 0.74 | ERN1 (0.51) | SRCTLR2ERN1TLR1TLR6 | |
| SCHEMBL1337138 | 0.72 | CYP2A6 (0.58) | CYP2A6IMPDH2SRCTLR2ERN1 | |
| SCHEMBL29955729 | 0.72 | CYP2A6 (0.58) | CYP2A6IMPDH2SRCTLR2ERN1 | |
| SCHEMBL31213227 | 0.72 | KDR (0.49) | CYP2A6IMPDH2PDGFRBKDRFLT4 | |
| SCHEMBL229717 | 0.72 | PDGFRB (0.46) | CYP2A6IMPDH2PDGFRBKDRFLT4 | |
| SCHEMBL8846481 | 0.71 | ERN1 (0.56) | SRCTLR2ERN1TLR1TLR6 |
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-1276720-A2 | 2-ACYL INDOL DERIVATIVES AND THEIR USE AS ANTI-TUMOUR AGENTS | ASTA Medica AG (DE) | 2003-01-22 | — | — | EP | disclosed |
| WO-2001082909-A2 | 2-ACYL INDOL DERIVATIVES AND THEIR USE AS ANTI-TUMOUR AGENTS | BAXTER HEALTHCARE SA (DE) | 2001-11-08 | — | — | WO | disclosed |