Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CTSD | P07339 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2941917 | 0.85 | CYP1A2 (0.54) | CYP1A2TSHRALDH1A1TDP1GPR35 | |
| SCHEMBL29834848 | 0.85 | CYP1A2 (0.54) | CYP1A2TSHRALDH1A1TDP1GPR35 | |
| SCHEMBL3241378 | 0.83 | CYP1A2 (0.49) | CYP1A2TSHRALDH1A1TDP1KDM4E | |
| SCHEMBL29557923 | 0.83 | CYP1A2 (0.49) | CYP1A2TSHRALDH1A1TDP1KDM4E | |
| SCHEMBL10686702 | 0.78 | CYP1A2 (0.67) | CYP1A2TSHRALDH1A1KDM4EMEN1 | |
| SCHEMBL28641859 | 0.74 | CYP1A2 (0.48) | CYP1A2TSHRALDH1A1KDM4EMEN1 | |
| SCHEMBL7156545 | 0.74 | ALDH1A1 (0.40) | CYP1A2TSHRALDH1A1TDP1KDM4E | |
| SCHEMBL267829 | 0.74 | CYP1A2 (0.53) | CYP1A2TSHRALDH1A1TDP1GPR35 | |
| SCHEMBL31145677 | 0.74 | CYP1A2 (0.53) | CYP1A2TSHRALDH1A1TDP1GPR35 | |
| SCHEMBL28716805 | 0.74 | ALDH1A1 (0.41) | CYP1A2TSHRALDH1A1TDP1KDM4E |
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-2004089529-A1 | METHOD FOR THE INTRAMOLECULAR ENERGY TRANSFER FOR THE CLEAVAGE OF LABILE FUNCTIONAL GROUP FROM BIOMOLECULES AND THE PROTECTED BIOMOLECULES | Universität Konstanz (DE) | 2004-10-21 | — | — | WO | disclosed |