Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 2/20 | 0.57 |
| ▸ | BCHE | P06276 | 2/20 | 0.57 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.56 |
| ▸ | PYCR1 | P32322 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 5/20 | 0.48 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 2/20 | 0.46 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL31612489 | 0.83 | BCHE (0.61) | TSHRACHEBCHESMPD1PYCR1 | |
| Hydrochloric Acid SCHEMBL31687476 | 0.81 | ACHE (0.56) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL27083413 | 0.81 | BCHE (0.63) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL4611890 | 0.81 | PYCR1 (0.69) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL18137973 | 0.80 | PYCR1 (0.59) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL17312007 | 0.79 | CARM1 (0.61) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL11122295 | 0.79 | PYCR1 (0.57) | TSHRACHEBCHESMPD1PYCR1 | |
| SCHEMBL2058653 | 0.78 | SIGMAR1 (0.65) | TSHRACHEALDH1A1SIGMAR1MAOB | |
| SCHEMBL6214827 | 0.78 | ALDH1A1 (0.56) | PYCR1ALDH1A1HTTSMN1; SMN2LMNA | |
| SCHEMBL8790447 | 0.78 | AOC3 (0.53) | TSHRACHEBCHESMPD1PYCR1 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |