Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.33 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | LCK | P06239 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | CASP1 | P29466 | 1/20 | 0.31 |
| ▸ | CASP7 | P55210 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL9846291 | 0.75 | PARP1 (0.35) | PARP1PIK3CDPIK3CBPIK3CGLCK | |
| SCHEMBL9846224 | 0.71 | PARP1 (0.37) | PARP1MEN1KMT2APIK3CDPIK3CB | |
| SCHEMBL9166348 | 0.71 | IDH1 (0.37) | PARP1PIK3CDPIK3CBPIK3CGALDH1A1 | |
| SCHEMBL9846141 | 0.64 | MAPT (0.38) | MEN1KMT2ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL10464540 | 0.63 | RXRA (0.41) | MEN1KMT2ALMNA | |
| SCHEMBL16674770 | 0.63 | NR4A2 (0.37) | MEN1KMT2AMAOASMN1; SMN2ALDH1A1 | |
| SCHEMBL11514781 | 0.62 | PSMB8 (0.37) | MEN1KMT2ASMN1; SMN2ALDH1A1ALOX15 | |
| SCHEMBL101890 | 0.61 | MAPT (0.39) | MEN1KMT2ASMN1; SMN2ALDH1A1 | |
| SCHEMBL15066674 | 0.61 | SMN1; SMN2 (0.46) | MEN1KMT2ASMN1; SMN2ALDH1A1LMNA | |
| SCHEMBL5077318 | 0.61 | ELANE (0.44) | PARP1MEN1KMT2ASMN1; SMN2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0462800-A2 | Inhibitors of HIV reverse transcriptase | MERCK & CO. INC. (US) | 1991-12-27 | — | — | EP | disclosed |