Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | FOLH1 | Q04609 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3703677 | 0.84 | METAP2 (0.40) | CYP2C9KDM4EALDH1A1MAPTRXFP1 | |
| SCHEMBL5020061 | 0.84 | METAP2 (0.40) | CYP2C9KDM4EALDH1A1MAPTRXFP1 | |
| SCHEMBL5020136 | 0.82 | L3MBTL1 (0.49) | CYP2C9KDM4EALDH1A1MAPTL3MBTL1 | |
| SCHEMBL7619577 | 0.82 | LMNA (0.35) | CYP2C9KDM4EALDH1A1MAPTRXFP1 | |
| SCHEMBL5020132 | 0.81 | CYP2C9 (0.37) | CYP2C9KDM4EALDH1A1MAPTFOLH1 | |
| SCHEMBL17277107 | 0.79 | KDM4E (0.31) | KDM4EALDH1A1MAPTRXFP1 | |
| SCHEMBL4955697 | 0.76 | NOD1 (0.42) | CYP2C9ALDH1A1FOLH1KMT2A | |
| SCHEMBL12890787 | 0.74 | ALOX15 (0.37) | CYP2C9ALDH1A1L3MBTL1TSHRALOX15 | |
| SCHEMBL18735049 | 0.73 | KMT2A (0.43) | CYP2C9MAPTL3MBTL1KMT2APOLB | |
| SCHEMBL14693833 | 0.73 | ITGB1 (0.46) | CYP2C9L3MBTL1TSHRBIRC2 |
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-2012065102-A2 | S-T-BUTYL PROTECTED CYSTEINE DI-PEPTIDE ANALOGS AND RELATED COMPOUNDS | PROMENTIS PHARMACEUTICALS, INC. (US) | 2012-05-18 | — | — | WO | disclosed |