Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | LMNA | P02545 | 2/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | MMP3 | P08254 | 2/20 | 0.42 |
| ▸ | MMP9 | P14780 | 2/20 | 0.42 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | BACE2 | Q9Y5Z0 | 1/20 | 0.39 |
| ▸ | FAAH | O00519 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7799794 | 1.00 | CYP2C19 (0.62) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL8749863 | 0.96 | CYP2C19 (0.61) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL9622341 | 0.96 | CYP2C19 (0.61) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL7045940 | 0.96 | CYP2C19 (0.61) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL9507072 | 0.92 | CYP2C19 (0.65) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL7776762 | 0.86 | CYP2C19 (0.62) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL7775183 | 0.85 | CYP2C19 (0.51) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL11529161 | 0.84 | CYP2C19 (0.68) | CYP2C19LMNAKMT2AMEN1TSHR | |
| SCHEMBL7773269 | 0.84 | CYP2C19 (0.50) | CYP2C19LMNAKMT2ATSHRCYP1A2 | |
| SCHEMBL9621846 | 0.83 | CYP2C19 (0.55) | CYP2C19LMNAKMT2AMEN1MMP2 |
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-5595741-A | Aminoalkylmaleimides and hapten and antigen derivatives derived therefrom as well as conjugates with peptides or proteins | BOEHRINGER MANNHEIM GMBH (DE) | 1997-01-21 | — | — | US | disclosed |