Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HTT | P42858 | 2/20 | 0.52 |
| ▸ | MITF | O75030 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | CASR | P41180 | 3/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3265762 | 0.85 | PKM (0.56) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL18575437 | 0.79 | PKM (0.57) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL22766709 | 0.79 | ALDH1A1 (0.48) | KMT2AALDH1A1HTTMITFLMNA | |
| SCHEMBL20909104 | 0.79 | CYP3A4 (0.61) | PKMKMT2AALDH1A1HTTMITF | |
| Methane SCHEMBL29025301 | 0.77 | CASR (0.59) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL918548 | 0.77 | CA1 (0.50) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL12226363 | 0.77 | CA1 (0.50) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL4589366 | 0.77 | PKM (0.54) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL8751378 | 0.76 | PKM (0.48) | PKMKMT2AALDH1A1HTTMITF | |
| SCHEMBL31080779 | 0.75 | PKM (0.54) | PKMKMT2AALDH1A1HTTMITF |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3694836-B1 | PROCESS FOR PREPARING INTERMEDIATE OF ANTI-TUMOR DRUG NIRAPARIB AND INTERMEDIATE THEREOF | ZAI LAB SHANGHAI CO LTD (CN) | 2022-06-15 | — | — | EP | disclosed |
| WO-2019072237-A1 | PROCESS FOR PREPARING INTERMEDIATE OF ANTI-TUMOR DRUG NIRAPARIB AND INTERMEDIATE THEREOF | ZAI LAB (SHANGHAI) CO., LTD. (CN) | 2019-04-18 | — | — | WO | disclosed |