Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 15/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 12/20 | 0.69 |
| ▸ | FGFR1 | P11362 | 5/20 | 0.69 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.69 |
| ▸ | STK10 | O94804 | 2/20 | 0.69 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.69 |
| ▸ | RET | P07949 | 2/20 | 0.69 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.69 |
| ▸ | DDR1 | Q08345 | 2/20 | 0.69 |
| ▸ | SLK | Q9H2G2 | 2/20 | 0.69 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.69 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.69 |
| ▸ | ABL1 | P00519 | 1/20 | 0.69 |
| ▸ | EGFR | P00533 | 1/20 | 0.69 |
| ▸ | LCK | P06239 | 1/20 | 0.69 |
| ▸ | CSF1R | P07333 | 1/20 | 0.69 |
| ▸ | HCK | P08631 | 1/20 | 0.69 |
| ▸ | KIT | P10721 | 1/20 | 0.69 |
| ▸ | SRC | P12931 | 1/20 | 0.69 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL12020489 | 0.85 | KDR (0.81) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL14140810 | 0.84 | KDR (0.77) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL1227548 | 0.84 | KDR (0.77) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL1226910 | 0.83 | KDR (1.00) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL12899428 | 0.83 | KDR (0.79) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL1227649 | 0.83 | KDR (0.76) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL15239413 | 0.83 | KDR (0.74) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL1227552 | 0.83 | KDR (0.77) | KDRCYP3A4FGFR1KCNH2STK10 | |
| Potassium Ion SCHEMBL4869310 | 0.82 | KDR (0.76) | KDRCYP3A4FGFR1KCNH2STK10 | |
| SCHEMBL1227526 | 0.82 | KDR (0.78) | KDRCYP3A4FGFR1KCNH2STK10 |
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-2010538-A1 | PROCESS FOR THE PREPARATION OF Ý(1R), 2S¨-2-AMINOPROPIONIC ACID 2-Ý4-(4-FLUORO-2-METHYL-1H-INDOL-5-YLOXY)-5-METHYLPYRROLOÝ2,1-f¨Ý1,2,4¨TRIAZIN-6-YLOXY¨-1-METHYLETHYL ESTER | Bristol-Myers Squibb Company (US) | 2009-01-07 | — | — | EP | disclosed |
| WO-2007124332-A1 | PROCESS FOR THE PREPARATION OF [(1R), 2S]-2-AMINOPROPIONIC ACID 2-[4-(4-FLUORO-2-METHYL-1H-INDOL-5-YLOXY)-5-METHYLPYRROLO[2,1-f][1,2,4]TRIAZIN-6-YLOXY]-1-METHYLETHYL ESTER | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-11-01 | — | — | WO | disclosed |
| WO-2007124332-A1 | PROCESS FOR THE PREPARATION OF [(1R), 2S]-2-AMINOPROPIONIC ACID 2-[4-(4-FLUORO-2-METHYL-1H-INDOL-5-YLOXY)-5-METHYLPYRROLO[2,1-f][1,2,4]TRIAZIN-6-YLOXY]-1-METHYLETHYL ESTER | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-11-01 | — | — | WO | disclosed |