Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 1/20 | 0.55 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.51 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | IDO1 | P14902 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 3/20 | 0.43 |
| ▸ | CREBBP | Q92793 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10285196 | 1.00 | MAOA (0.55) | MAOAMAOBPDE3BPDE3ASMN1; SMN2 | |
| SCHEMBL1038757 | 0.88 | SMN1; SMN2 (0.52) | MAOAMAOBPDE3BPDE3ASMN1; SMN2 | |
| SCHEMBL12470042 | 0.81 | GAA (0.56) | MAOAMAOBSMN1; SMN2GAAALDH1A1 | |
| SCHEMBL434946 | 0.79 | BRD4 (0.53) | TP53ACHEIDO1MEN1KMT2A | |
| SCHEMBL30866425 | 0.79 | KMT2A (0.60) | MAOAMAOBSMN1; SMN2GAAALDH1A1 | |
| SCHEMBL880263 | 0.79 | KMT2A (0.60) | MAOAMAOBSMN1; SMN2GAAALDH1A1 | |
| SCHEMBL16339845 | 0.79 | MAOA (0.49) | MAOAMAOBPDE3BPDE3ASMN1; SMN2 | |
| SCHEMBL17479629 | 0.78 | CA9 (0.44) | PDE3BPDE3AALDH1A1BRD4CREBBP | |
| SCHEMBL7264599 | 0.78 | KMT2A (0.45) | PDE3BPDE3ATP53IDO1MEN1 | |
| SCHEMBL30293265 | 0.78 | BRD4 (0.57) | MAOAMAOBPDE3BPDE3AALDH1A1 |
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-109988093-B | Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine | 广东东阳光药业有限公司 | 2023-04-07 | — | — | CN | disclosed |