Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.40 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.40 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CCKAR | P32238 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27831733 | 0.76 | CYP2D6 (0.34) | CYP2D6SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL27811377 | 0.76 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL2302811 | 0.72 | SLC6A4 (0.58) | EGFRPIK3CACYP2D6SLC6A2SLC6A4 | |
| SCHEMBL1616290 | 0.71 | MMP13 (0.47) | NHERF1KDM4EALDH1A1TP53PDGFRB | |
| SCHEMBL14014109 | 0.70 | XDH (0.44) | EGFRPIK3CAKDM4EMAPTPDGFRB | |
| Isopropyl Alcohol SCHEMBL11540479 | 0.70 | FLT3 (0.61) | EGFRPIK3CAKDM4EALDH1A1MAPT | |
| SCHEMBL13157412 | 0.68 | SLC6A2 (0.43) | EGFRPIK3CAKDM4EALDH1A1MAPT | |
| SCHEMBL118686 | 0.67 | FLT3 (0.71) | KDM4EALDH1A1MAPTTP53PDGFRB | |
| SCHEMBL29362757 | 0.67 | FLT3 (0.71) | KDM4EALDH1A1MAPTTP53PDGFRB | |
| SCHEMBL1616734 | 0.67 | FLT3 (0.40) | KDM4EALDH1A1PDGFRBPDGFRALMNA |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102099031-A | Substituted indolyl and indazolyl derivatives and their use | HOFFMANN LA ROCHE | 2011-06-15 | — | — | CN | claimed |
| CN-102099031-A | Substituted indolyl and indazolyl derivatives and their use | HOFFMANN LA ROCHE | 2011-06-15 | — | — | CN | disclosed |
| EP-2307008-A1 | SUBSTITUTED INDOLYL AND INDAZOLYL DERIVATIVES AND USES THEREOF | F. Hoffmann-La Roche AG (CH) | 2011-04-13 | — | — | EP | disclosed |
| WO-2010006945-A1 | SUBSTITUTED INDOLYL AND INDAZOLYL DERIVATIVES AND USES THEREOF | F. HOFFMANN-LA ROCHE AG (CH) | 2010-01-21 | — | — | WO | disclosed |