Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | ACE | P12821 | 7/20 | 0.56 |
| ▸ | MME | P08473 | 1/20 | 0.56 |
| ▸ | CPA1 | P15085 | 1/20 | 0.56 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.56 |
| ▸ | ERAP2 | Q6P179 | 6/20 | 0.53 |
| ▸ | IL1RN | P18510 | 4/20 | 0.53 |
| ▸ | LNPEP | Q9UIQ6 | 3/20 | 0.53 |
| ▸ | ERAP1 | Q9NZ08 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | MDM4 | O15151 | 1/20 | 0.50 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | NPY4R | P50391 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL27439125 | 0.89 | ALDH1A1 (0.64) | TSHRACEMMECPA1ACE2 | |
| SCHEMBL10448416 | 0.89 | ALDH1A1 (0.64) | TSHRACEMMECPA1ACE2 | |
| SCHEMBL10448491 | 0.89 | ALDH1A1 (0.64) | TSHRACEMMECPA1ACE2 | |
| Hydrochloric Acid SCHEMBL10448415 | 0.88 | ALDH1A1 (0.63) | TSHRACEMMECPA1ACE2 | |
| Hydrochloric Acid SCHEMBL10448414 | 0.88 | ALDH1A1 (0.63) | TSHRACEMMECPA1ACE2 | |
| SCHEMBL4261774 | 0.87 | ACE (0.73) | ACEMMECPA1ACE2 | |
| SCHEMBL31202567 | 0.87 | ACE (0.73) | ACEMMECPA1ACE2 | |
| SCHEMBL29669675 | 0.87 | ACE (0.73) | ACEMMECPA1ACE2 | |
| Hydrochloric Acid SCHEMBL11427427 | 0.87 | TSHR (0.61) | TSHRERAP2IL1RNLNPEPERAP1 | |
| SCHEMBL30411231 | 0.87 | ACE (0.73) | ACEMMECPA1ACE2 |
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-1062536-A | Retroviral protease inhibitors from 3-chloro-2-chloromethyl-1-propylene derived | AMERICAN CYANAMID CO (US) | 1992-07-08 | — | — | CN | disclosed |