Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.60 |
| ▸ | GFER | P55789 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MAOB | P27338 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | XDH | P47989 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | DAO | P14920 | 2/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL27765333 | 0.91 | SCN9A (0.56) | HPGDGFERALDH1A1MAOBLMNA | |
| SCHEMBL27787215 | 0.90 | ALDH1A1 (0.57) | HPGDGFERALDH1A1MAOBLMNA | |
| SCHEMBL27765512 | 0.89 | DAO (0.55) | HPGDGFERALDH1A1MAOBLMNA | |
| SCHEMBL28784418 | 0.89 | HPGD (0.62) | HPGDGFERALDH1A1MAOBLMNA | |
| SCHEMBL27787221 | 0.86 | CTSB (0.62) | HPGDGFERALDH1A1LMNAPOLB | |
| SCHEMBL27765156 | 0.84 | ALDH1A1 (0.52) | HPGDGFERALDH1A1LMNATSHR | |
| SCHEMBL27787214 | 0.84 | MAOB (0.62) | HPGDALDH1A1MAOBDAO | |
| SCHEMBL27787222 | 0.83 | MAOB (0.58) | HPGDGFERALDH1A1MAOBTSHR | |
| SCHEMBL27765295 | 0.83 | ALDH1A1 (0.46) | HPGDGFERALDH1A1MAOBLMNA | |
| SCHEMBL27765254 | 0.83 | HPGD (0.49) | HPGDGFERALDH1A1LMNATSHR |
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 |
|---|---|---|---|---|---|---|---|
| CN-101597263-A | Preparation of novel S-DABO HIV-1 reverse transcriptase inhibitor and uses thereof | UNIV CAPITAL MEDICAL (CN) | 2009-12-09 | — | — | CN | disclosed |