Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | MMP13 | P45452 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | PLA2G4A | P47712 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP2 | P08253 | 1/20 | 0.44 |
| ▸ | MMP9 | P14780 | 1/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6292813 | 0.87 | TSHR (0.56) | KMT2ATDP1ALDH1A1LMNAMAPT | |
| SCHEMBL3001518 | 0.86 | GSK3B (0.52) | ALDH1A1LMNASMN1; SMN2RAB9APLA2G4A | |
| SCHEMBL10769157 | 0.83 | TDP1 (0.49) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL289069 | 0.73 | CAPN1 (0.51) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 | |
| SCHEMBL8985073 | 0.73 | GSK3B (0.67) | KMT2AALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL9737125 | 0.73 | FOLH1 (0.48) | KMT2AALDH1A1LMNAMAPTSMN1; SMN2 | |
| SCHEMBL28369636 | 0.72 | TDP1 (0.49) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 | |
| Benzyl Benzoate SCHEMBL8010992 | 0.71 | KMT2A (1.00) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 | |
| Benzyl Benzoate SCHEMBL3038 | 0.71 | KMT2A (1.00) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 | |
| Benzyl Benzoate SCHEMBL901058 | 0.71 | KMT2A (1.00) | KMT2ATDP1SLC6A2SLC6A3ALDH1A1 |
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-4739071-A | Process for the preparation of enantiomers | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-04-19 | — | — | US | disclosed |