Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 4/20 | 0.65 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.65 |
| ▸ | PTGS2 | P35354 | 8/20 | 0.58 |
| ▸ | KIF11 | P52732 | 1/20 | 0.58 |
| ▸ | MDM4 | O15151 | 1/20 | 0.50 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CCND1 | P24385 | 1/20 | 0.46 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.46 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.46 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.46 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4816763 | 0.86 | PTGS2 (0.74) | ESR1ESR2PTGS2HPGDKDM4E | |
| SCHEMBL5605370 | 0.84 | ESR1 (0.79) | ESR1ESR2PTGS2MAPK14 | |
| SCHEMBL28855250 | 0.82 | CNR1 (0.51) | ESR1ESR2PTGS2KIF11MDM4 | |
| SCHEMBL18610257 | 0.81 | ESR1 (0.73) | ESR1ESR2PTGS2KDM4EGFER | |
| SCHEMBL28820977 | 0.80 | PTGS2 (0.74) | ESR1ESR2PTGS2HPGDMAPK14 | |
| SCHEMBL28906383 | 0.80 | KIF11 (0.54) | ESR1ESR2PTGS2KIF11MDM4 | |
| SCHEMBL28960401 | 0.80 | MDM4 (0.68) | PTGS2KIF11MDM4MDM2HPGD | |
| SCHEMBL5193971 | 0.79 | ESR1 (0.73) | ESR1ESR2PTGS2HPGDKDM4E | |
| SCHEMBL15632215 | 0.79 | ESR1 (0.65) | ESR1ESR2PTGS2HPGDALDH1A1 | |
| SCHEMBL29799621 | 0.79 | ESR1 (1.00) | ESR1ESR2PTGS2HPGDKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-103755621-B | The method of polysubstituted indoles is prepared by aryl hydrazines and alkynes | TSINGHUA UNIVERSITY (CN) | 2015-08-05 | — | — | CN | disclosed |