Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.50 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.50 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.50 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 6/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PLEC | Q15149 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10426213 | 0.87 | CYP2D6 (0.49) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL11675696 | 0.82 | ALOX5 (0.47) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL67463 | 0.81 | CYP3A4 (0.62) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL2120858 | 0.79 | CYP3A4 (0.59) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL2919093 | 0.79 | CYP3A4 (0.59) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL11613709 | 0.77 | CYP3A4 (0.56) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL4136744 | 0.76 | CYP3A4 (0.54) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL27919070 | 0.76 | CYP3A4 (0.54) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL5624162 | 0.74 | CYP2D6 (0.45) | CYP3A4TSHRTDP1GABRA1GABRB1 | |
| SCHEMBL18224 | 0.74 | CYP3A4 (1.00) | CYP3A4TSHRTDP1GABRA1GABRB1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103012196-B | 2- [ (2-hydroxy) -benzylimino ] methylphenol complex and preparation and application thereof | PETROCHINA COMPANY LIMITED (CN) | 2015-09-23 | — | — | CN | disclosed |
| CN-103012196-A | 2- [ (2-hydroxy) -benzylimino ] methylphenol complex and preparation and application thereof | PETROCHINA CO LTD | 2013-04-03 | — | — | CN | disclosed |
| US-20070026398-A1 | Protein tyrosine phosphatase-prl-1 a a marker and therapeutic target for pancreatic cancer | ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA | 2007-02-01 | — | — | US | disclosed |