Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | TNF | P01375 | 5/20 | 0.51 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.47 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.47 |
| ▸ | PDE2A | O00408 | 1/20 | 0.47 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.47 |
| ▸ | PDE5A | O76074 | 1/20 | 0.47 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30789070 | 0.89 | MEN1 (0.46) | MEN1KMT2ATNFSMN1; SMN2MAPT | |
| SCHEMBL30789071 | 0.89 | MEN1 (0.46) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| SCHEMBL30789068 | 0.82 | MEN1 (0.59) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| SCHEMBL2460475 | 0.82 | MEN1 (0.66) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL1022954 | 0.81 | MEN1 (0.64) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| Bromide SCHEMBL8002743 | 0.81 | MEN1 (0.60) | MEN1KMT2APDE10ASMN1; SMN2USP2 | |
| SCHEMBL30789065 | 0.80 | MEN1 (0.56) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| SCHEMBL4655563 | 0.76 | MEN1 (0.55) | MEN1KMT2ATNFPDE10ASMN1; SMN2 | |
| SCHEMBL13127348 | 0.74 | KDM4E (0.47) | MEN1KMT2ASMN1; SMN2ALDH1A1CYP3A4 | |
| SCHEMBL4712213 | 0.74 | PDE10A (0.57) | MEN1KMT2ATNFPDE10AACHE |
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-117420227-A | Method for detecting metabolite by using compound 4- (6, 7-dimethoxy-1, 2,3, 4-tetrahydroisoquinolin-1-yl) -N, N-dimethylaniline | 中国科学院新疆理化技术研究所 | 2024-01-19 | — | — | CN | disclosed |