Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 6/20 | 0.58 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | HTR2C | P28335 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GPR183 | P32249 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | PKLR | P30613 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12778129 | 0.87 | KDM4E (0.56) | TDO2HTR2AHTR2CPKMALDH1A1 | |
| SCHEMBL12778084 | 0.86 | KDM4E (0.58) | TDO2HTR2AHTR2CUSP2PKM | |
| SCHEMBL12778097 | 0.86 | KDM4E (0.58) | TDO2HTR2AHTR2CUSP2PKM | |
| SCHEMBL12778126 | 0.80 | OTUD7B (0.43) | TDO2HTR2AHTR2CPKMGPR183 | |
| SCHEMBL2081742 | 0.78 | ALDH1A1 (0.73) | TDO2USP2PKMALDH1A1KDM4E | |
| SCHEMBL12778115 | 0.78 | NPC1 (0.71) | HTR2AHTR2CALDH1A1KDM4ETRPV4 | |
| SCHEMBL28213830 | 0.78 | PKM (0.54) | TDO2HTR2AHTR2CUSP2PKM | |
| SCHEMBL12778134 | 0.77 | HTR2A (0.43) | TDO2HTR2AHTR2CPKMGPR183 | |
| SCHEMBL12778088 | 0.76 | HTR2A (0.49) | TDO2HTR2AHTR2CPKMGPR183 | |
| SCHEMBL24762218 | 0.75 | TDO2 (0.53) | TDO2USP2PKMALDH1A1TSHR |
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-2007059229-A1 | HIV INTEGRASE INHIBITORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2007-05-24 | — | — | WO | disclosed |