Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | STAT6 | P42226 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 9/20 | 0.39 |
| ▸ | THRA | P10827 | 8/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL4 | Q8NA19 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TERT | O14746 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19330612 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C9STAT6 | |
| SCHEMBL19330426 | 0.77 | ALDH1A1 (0.53) | ALDH1A1CYP1A2CYP3A4CYP2C9STAT6 | |
| SCHEMBL19330148 | 0.77 | TDP1 (0.61) | ALDH1A1CYP1A2HSD17B10POLBTDP1 | |
| SCHEMBL19330152 | 0.76 | ALDH1A1 (0.55) | ALDH1A1CYP1A2HSD17B10POLBTDP1 | |
| SCHEMBL19330334 | 0.75 | POLB (0.41) | ALDH1A1CYP1A2HSD17B10POLBTDP1 | |
| SCHEMBL30701127 | 0.75 | POLB (0.41) | ALDH1A1CYP1A2HSD17B10POLBTDP1 | |
| SCHEMBL26731664 | 0.72 | THRA (0.44) | ALDH1A1CYP1A2CYP3A4CYP2C9STAT6 | |
| SCHEMBL19330767 | 0.71 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4CYP2C9STAT6 | |
| SCHEMBL30701055 | 0.71 | ALDH1A1 (0.42) | ALDH1A1CYP1A2CYP3A4CYP2C9STAT6 | |
| SCHEMBL19330798 | 0.70 | THRA (0.46) | ALDH1A1THRBTHRAKDM4E |
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-109069514-B | Antibacterial compound and application thereof | 结核病药物开发全球联盟公司 | 2023-12-29 | — | — | CN | disclosed |