Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 13/20 | 0.69 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 2/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.31 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.31 |
| ▸ | EGFR | P00533 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TTR | P02766 | 1/20 | 0.31 |
| ▸ | ESR1 | P03372 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8952151 | 0.91 | AHR (0.82) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL8952194 | 0.83 | AHR (0.78) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL31696700 | 0.82 | AHR (1.00) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL9345588 | 0.82 | AHR (1.00) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL2884895 | 0.80 | AHR (0.67) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL30431628 | 0.78 | AHR (0.70) | AHRALDH1A1FLT1MAPK1 | |
| SCHEMBL8952199 | 0.78 | AHR (0.64) | AHRALDH1A1TSHRHSD17B10CYP3A4 | |
| SCHEMBL8958639 | 0.78 | AHR (0.70) | AHRALDH1A1FLT1MAPK1 | |
| SCHEMBL7887922 | 0.77 | AHR (0.74) | AHRTSHRHSD17B10CYP3A4FLT1 | |
| SCHEMBL8952143 | 0.72 | AHR (0.62) | AHRALDH1A1FLT1CA12CA9 |
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-2008059368-A2 | FUSED 2-AMINO PYRIMIDINE COMPOUNDS AND THEIR USE FOR THE TREATMENT OF CANCER | PFIZER PRODUCTS INC. (US) | 2008-05-22 | — | — | WO | disclosed |