Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HAVCR2 | Q8TDQ0 | 1/20 | 0.49 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.42 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GABRP | O00591 | 2/20 | 0.39 |
| ▸ | GABRD | O14764 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7047957 | 0.83 | AKR1C2 (0.51) | HAVCR2AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL29617335 | 0.83 | AKR1C2 (0.51) | HAVCR2AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL440854 | 0.79 | AURKA (0.57) | SMN1; SMN2KMT2AAURKAAURKBKDM4E | |
| SCHEMBL435967 | 0.78 | NR4A2 (0.38) | CYP3A4TSHRAURKAAURKBALDH1A1 | |
| SCHEMBL438978 | 0.75 | HAVCR2 (0.64) | HAVCR2AKR1C4AKR1C3AKR1C2AKR1C1 | |
| SCHEMBL438230 | 0.73 | NR4A2 (0.35) | KMT2AAURKAAURKBHTT | |
| SCHEMBL9389667 | 0.73 | KMO (0.40) | SMN1; SMN2KMT2AALDH1A1MEN1MAPT | |
| SCHEMBL7691286 | 0.72 | MAPK1 (0.42) | AKR1C4AKR1C3AKR1C2AKR1C1CYP3A4 | |
| SCHEMBL442311 | 0.72 | KDM4E (0.40) | HAVCR2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL440411 | 0.72 | HAVCR2 (0.52) | HAVCR2TSHRCASP1SMN1; SMN2KMT2A |
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-20120065166-A1 | Bone Modulators And Methods Therewith | ESPINA VIRGINIA (US) | 2012-03-15 | — | — | US | disclosed |