Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.43 |
| ▸ | MAOA | P21397 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | CA9 | Q16790 | 2/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.37 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL27588592 | 0.83 | PNMT (0.40) | CYP3A4SMN1; SMN2ALDH1A1 | |
| SCHEMBL27606468 | 0.79 | ENPP2 (0.44) | CA2CA9CYP3A4MAPTLMNA | |
| SCHEMBL27588567 | 0.78 | CYP3A4 (0.50) | MAOBMAOACYP19A1CA1CA2 | |
| SCHEMBL486262 | 0.77 | CALM1 (0.46) | LMNARAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL27606407 | 0.76 | ALDH1A1 (0.40) | MAOBMAOAALDH1A1 | |
| SCHEMBL30583096 | 0.74 | MAOB (0.62) | MAOBMAOACYP19A1CA1CA2 | |
| SCHEMBL49433 | 0.74 | MAOB (0.62) | MAOBMAOACYP19A1CA1CA2 | |
| SCHEMBL27606385 | 0.74 | HRH3 (0.39) | CA1CA2CA9CA12CA7 | |
| Hydrochloric Acid SCHEMBL10936113 | 0.72 | MAOB (0.64) | MAOBMAOACYP19A1CA1CA2 | |
| SCHEMBL9719335 | 0.72 | MAOB (0.60) | MAOBMAOACYP19A1CA1CA2 |
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-1553900-A | Acylsemicarbazides as cyclin dependent kinase inhibitors useful as anti-cancer and anti-proliferative agents | ��ʱ��ʩ����ҩ��˾ | 2004-12-08 | — | — | CN | disclosed |