Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 9/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 5/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5407163 | 0.85 | HTT (0.58) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL30235266 | 0.82 | HTT (0.58) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL18087973 | 0.82 | HTT (0.58) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL27593208 | 0.81 | HTT (0.46) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL6210671 | 0.80 | HTT (0.53) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL755913 | 0.79 | HTT (0.68) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL30729438 | 0.79 | HTT (0.68) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL20786648 | 0.79 | MAPT (0.45) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL14101860 | 0.78 | ERN1 (0.50) | HTTMAPTTDP1SMN1; SMN2HPGD | |
| SCHEMBL2766450 | 0.78 | MAPT (0.63) | MAPTTDP1SMN1; SMN2HPGDNPC1 |
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-109422737-B | Imidazolone androgen receptor antagonist, preparation method and application thereof | 上海时莱生物技术有限公司 | 2021-07-30 | — | — | CN | disclosed |