Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.40 |
| ▸ | PNMT | P11086 | 1/20 | 0.40 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | LOXL2 | Q9Y4K0 | 2/20 | 0.39 |
| ▸ | NOS1 | P29475 | 5/20 | 0.38 |
| ▸ | NOS2 | P35228 | 5/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.37 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.37 |
| ▸ | PRMT8 | Q9NR22 | 1/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | S100B | P04271 | 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 | |
|---|---|---|---|---|
| SCHEMBL3510031 | 0.89 | ALDH1A1 (0.55) | ALDH1A1CYP3A4TSHRPNMTENPP2 | |
| SCHEMBL28084794 | 0.87 | ALDH1A1 (0.46) | ALDH1A1CYP3A4TSHRPNMTENPP2 | |
| SCHEMBL8150219 | 0.84 | KDM4E (0.43) | ALDH1A1CYP3A4TSHRKDM4ETDP1 | |
| SCHEMBL27571569 | 0.83 | ALDH1A1 (0.44) | ALDH1A1CYP3A4TSHRPNMTENPP2 | |
| SCHEMBL27763796 | 0.82 | THRA (0.49) | ALDH1A1CYP3A4TSHRAOC3ENPP2 | |
| SCHEMBL30197097 | 0.81 | GFER (0.46) | ALDH1A1CYP3A4TSHRAOC3KDM4E | |
| SCHEMBL6731838 | 0.81 | ALDH1A1 (0.46) | ALDH1A1CYP3A4AOC3KDM4ETDP1 | |
| SCHEMBL1029106 | 0.81 | GFER (0.46) | ALDH1A1CYP3A4TSHRAOC3KDM4E | |
| SCHEMBL27964845 | 0.78 | MTNR1B (0.54) | SMN1; SMN2MAPT | |
| SCHEMBL2215316 | 0.77 | TSHR (0.55) | ALDH1A1CYP3A4TSHRAOC3TDP1 |
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-1856498-A | Thienopyridine and furopyridine kinase inhibitors | ABBOTT LAB (US) | 2006-11-01 | — | — | CN | disclosed |