Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | KLK1 | P06870 | 1/20 | 0.46 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CTSL | P07711 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 2/20 | 0.42 |
| ▸ | CTSB | P07858 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL7304322 | 0.85 | CYP3A4 (0.53) | CYP3A4TSHRMAPTNPBWR1NPSR1 | |
| SCHEMBL7146807 | 0.83 | CYP3A4 (0.54) | CYP3A4TSHRALDH1A1SMN1; SMN2HTT | |
| SCHEMBL16201457 | 0.82 | ATM (0.54) | CYP3A4TSHRALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL6958944 | 0.82 | ATM (0.54) | CYP3A4TSHRALDH1A1SMN1; SMN2MAPK1 | |
| SCHEMBL9683154 | 0.81 | MAPT (0.51) | CYP3A4TSHRMAPTNPBWR1NPSR1 | |
| SCHEMBL5700948 | 0.79 | F2 (0.49) | CYP3A4TSHRALDH1A1CASP1CTSL | |
| SCHEMBL5700951 | 0.79 | F2 (0.49) | CYP3A4TSHRALDH1A1CASP1CTSL | |
| SCHEMBL13588071 | 0.77 | MDM4 (0.61) | TSHRALDH1A1CTSLCTSSCTSB | |
| SCHEMBL28902023 | 0.77 | MDM4 (0.61) | TSHRALDH1A1CTSLCTSSCTSB | |
| SCHEMBL14501542 | 0.77 | MAPK1 (0.55) | CYP3A4TSHRMAPTNPBWR1NPSR1 |
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-2004091542-A2 | NITROGEN CONTAINING INTEGRIN TARGETING COMPOUNDS | COVX PHARMACEUTICALS, INC. (US) | 2004-10-28 | — | — | WO | disclosed |