Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.44 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.44 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.40 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.38 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9259759 | 0.81 | ALDH1A1 (0.66) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL10567718 | 0.73 | TDP1 (0.38) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL1401531 | 0.68 | ALDH1A1 (0.54) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL8187684 | 0.66 | ALDH1A1 (0.55) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL9559771 | 0.64 | ALDH1A1 (0.43) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL6203515 | 0.63 | ALDH1A1 (0.68) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL1995690 | 0.63 | ALDH1A1 (0.56) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL29398386 | 0.63 | ALDH1A1 (0.56) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL24118044 | 0.62 | MAPK1 (0.59) | CYP3A4ALDH1A1TSHRTDP1HPGD | |
| SCHEMBL9952299 | 0.62 | CYP3A4 (0.59) | CYP3A4ALDH1A1TSHRTDP1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-4859606-A | Method for detecting cations in a test sample utilizing chromogenic cryptahemispherands | TECHNICON INSTRUMENTS CORPORATION (US) | 1989-08-22 | — | — | US | disclosed |