Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.44 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MITF | O75030 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.41 |
| ▸ | ACMSD | Q8TDX5 | 2/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26188336 | 0.79 | HPGD (0.49) | ALDH1A1KMT2ASMN1; SMN2NPC1HPGD | |
| SCHEMBL12047054 | 0.78 | SMN1; SMN2 (0.53) | ALDH1A1KMT2ASMN1; SMN2HPGDPTGDR2 | |
| SCHEMBL26188325 | 0.76 | CNR2 (0.44) | ALDH1A1KMT2ASMN1; SMN2NPC1HPGD | |
| Formaldehyde SCHEMBL28166410 | 0.76 | HPGD (0.40) | ALDH1A1KMT2ASMN1; SMN2NPC1HPGD | |
| SCHEMBL4081642 | 0.76 | ALDH1A1 (1.00) | ALDH1A1KMT2ASMN1; SMN2KDM4CKDM4E | |
| SCHEMBL4134865 | 0.75 | PTGDR2 (0.54) | ALDH1A1KMT2ASMN1; SMN2NPC1HPGD | |
| SCHEMBL11806074 | 0.73 | ACMSD (0.53) | ALDH1A1KMT2APTGDR2MEN1KDM4E | |
| SCHEMBL18863213 | 0.73 | PTGDR2 (0.51) | PTGDR2PTGDRACMSDHTTCAMKK1 | |
| SCHEMBL28365983 | 0.73 | ALDH1A1 (0.73) | ALDH1A1KMT2ASMN1; SMN2HPGDKDM4E | |
| SCHEMBL1316975 | 0.73 | ALDH1A1 (0.73) | ALDH1A1KMT2AHPGDMEN1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023160004-A1 | FUSED-RING COMPOUND HAVING ANALGESIC ACTIVITY, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 南京知和医药科技有限公司 | 2023-08-31 | — | — | WO | disclosed |