Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CCR1 | P32246 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | ANPEP | P15144 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | CNR2 | P34972 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL8089676 | 1.00 | SMN1; SMN2 (0.57) | SMN1; SMN2CCR1MAPK1ANPEPMEN1 | |
| SCHEMBL18822410 | 0.90 | CCR1 (0.57) | SMN1; SMN2CCR1ANPEPHDAC2HDAC8 | |
| SCHEMBL5711363 | 0.86 | ALDH1A1 (0.56) | SMN1; SMN2CCR1HDAC2HDAC8HDAC6 | |
| SCHEMBL6446379 | 0.86 | ALDH1A1 (0.56) | SMN1; SMN2CCR1HDAC2HDAC8HDAC6 | |
| SCHEMBL6138017 | 0.85 | MME (0.55) | SMN1; SMN2HDAC2HDAC8HDAC6HDAC3 | |
| SCHEMBL5917036 | 0.85 | POLB (0.59) | CCR1ANPEPMEN1KMT2AATM | |
| SCHEMBL5917035 | 0.85 | POLB (0.59) | CCR1ANPEPMEN1KMT2AATM | |
| SCHEMBL16114864 | 0.85 | POLB (0.59) | CCR1ANPEPMEN1KMT2AATM | |
| SCHEMBL9830901 | 0.85 | POLB (0.59) | CCR1ANPEPMEN1KMT2AATM | |
| SCHEMBL26903372 | 0.82 | CCR1 (0.51) | SMN1; SMN2CCR1HDAC2ALDH1A1HPGD |
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 |
|---|---|---|---|---|---|---|---|
| EP-0817795-B1 | NOVEL 4-SUBSTITUTED-3-PEPTIDYL-AZETIDIN-2-ONE DERIVATIVES USEFUL AS CYSTEINE PROTEINASE INHIBITOR | NAEJA PHARMACEUTICAL INC (CA) | 2000-11-15 | — | — | EP | claimed |