Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 6/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | ROS1 | P08922 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11771718 | 0.76 | KDR (0.49) | PTGS2KDRKDM4EMEN1ALDH1A1 | |
| SCHEMBL1672794 | 0.76 | PTGS2 (0.44) | PTGS2BRD4MAPTRAB9ASMN1; SMN2 | |
| SCHEMBL1670425 | 0.74 | PTGS2 (0.41) | PTGS2BRD4MAPTMEN1ALDH1A1 | |
| SCHEMBL1670708 | 0.74 | PTGS2 (0.43) | PTGS2BRD4MAPTLMNAKDM4E | |
| SCHEMBL3270536 | 0.73 | MAPK9 (0.51) | PTGS2KDRMAPTKDM4EMEN1 | |
| SCHEMBL28186197 | 0.73 | KDR (0.55) | KDRKDM4EMEN1ALDH1A1HPGD | |
| SCHEMBL1670909 | 0.71 | PTGS2 (0.40) | PTGS2BRD4MAPTKDM4EMEN1 | |
| SCHEMBL29975108 | 0.70 | GLA (0.55) | PTGS2KDRMAPTRAB9A | |
| SCHEMBL28186123 | 0.70 | GLA (0.55) | PTGS2KDRMAPTRAB9A | |
| SCHEMBL17484575 | 0.70 | KDR (0.50) | KDRMAPTKDM4EMEN1ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011042477-A1 | SUBSTITUTED PYRROLES AND IMIDAZOLES AS ESTROGEN RECEPTOR LIGANDS | KARO BIO AB (SE) | 2011-04-14 | — | — | WO | disclosed |