Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | CFTR | P13569 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | GOPC | Q9HD26 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 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 | |
|---|---|---|---|---|
| SCHEMBL13770053 | 0.90 | PSMB8 (0.33) | ABCB1HDAC6HSP90AA1 | |
| SCHEMBL1095524 | 0.89 | HDAC6 (0.33) | ABCB1HDAC6USP2CFTRPAX8 | |
| SCHEMBL12836878 | 0.88 | ABCB1 (0.35) | ABCB1USP2CFTRPAX8ATM | |
| SCHEMBL1095312 | 0.82 | HDAC6 (0.32) | HDAC6 | |
| SCHEMBL4085633 | 0.81 | HDAC6 (0.34) | ABCB1HDAC6USP2CFTRPAX8 | |
| SCHEMBL13770438 | 0.81 | FTO (0.45) | ABCB1USP2CFTRPAX8ATM | |
| SCHEMBL14338739 | 0.80 | ABCB1 (0.43) | ABCB1USP2CFTRPAX8ATM | |
| SCHEMBL1095518 | 0.80 | PSMB8 (0.32) | HDAC6 | |
| SCHEMBL25208865 | 0.79 | KDM4E (0.34) | HDAC6USP2HSP90AA1MEN1MAPT | |
| SCHEMBL14078004 | 0.79 | KDM4E (0.31) | HDAC6USP2MEN1MAPTHPGD |
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-2009086509-A2 | REAGENTS FOR BIOMOLECULAR LABELING, DETECTION AND QUANTIFICATION EMPLOYING RAMAN SPECTROSCOPY | PURDUE RESEARCH FOUNDATION (US) | 2009-07-09 | — | — | WO | disclosed |