Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.34 |
| ▸ | CA9 | Q16790 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 4/20 | 0.32 |
| ▸ | IDO1 | P14902 | 2/20 | 0.32 |
| ▸ | TDO2 | P48775 | 2/20 | 0.32 |
| ▸ | TGM2 | P21980 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | RET | P07949 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10883413 | 1.00 | GABRA1 (0.37) | GABRA1GABRG2GABRB3GABRB1GABRB2 | |
| SCHEMBL10908215 | 0.91 | GABRA1 (0.37) | GABRA1GABRG2GABRB3GABRB1GABRB2 | |
| SCHEMBL10882364 | 0.88 | CA12 (0.46) | GABRA1GABRG2GABRB3GABRB1GABRB2 | |
| SCHEMBL10883408 | 0.88 | CA12 (0.46) | GABRA1GABRG2GABRB3GABRB1GABRB2 | |
| SCHEMBL10881532 | 0.86 | CA12 (0.32) | CA12CA9CA1CA2 | |
| SCHEMBL10908992 | 0.86 | CA12 (0.32) | CA12CA9CA1CA2 | |
| SCHEMBL10907274 | 0.83 | CNR1 (0.34) | — | |
| SCHEMBL10907309 | 0.83 | CA12 (0.33) | CA12CA9CA1 | |
| SCHEMBL10907307 | 0.83 | CA12 (0.33) | CA12CA9CA1 | |
| SCHEMBL10882230 | 0.83 | CA9 (0.47) | CA12CA9CA2 |
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-4563474-A | PSYCHOLOGICAL DISORDERS | BASF AKTIENGESELLSCHAFT (DE) | 1986-01-07 | — | — | US | disclosed |