Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 4/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 4/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 3/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 3/20 | 0.57 |
| ▸ | APAF1 | O14727 | 2/20 | 0.57 |
| ▸ | NSD2 | O96028 | 2/20 | 0.57 |
| ▸ | TDP2 | O95551 | 1/20 | 0.57 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.57 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.57 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.57 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | SRD5A1 | P18405 | 2/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.44 |
| ▸ | CTSV | O60911 | 2/20 | 0.44 |
| ▸ | CTSL | P07711 | 2/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.44 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7991450 | 0.87 | CASP3 (0.65) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL7991616 | 0.86 | CASP3 (0.64) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL7991749 | 0.84 | CASP3 (0.61) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL7995165 | 0.81 | CASP3 (0.60) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL23457419 | 0.78 | CASP3 (0.66) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL23458036 | 0.78 | CASP3 (0.76) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL21951885 | 0.76 | MRGPRX1 (0.49) | LMNASRD5A1SRD5A2PDE10ACTSV | |
| SCHEMBL27392243 | 0.75 | SRD5A1 (0.53) | LMNASRD5A1SRD5A2CTSVCTSL | |
| SCHEMBL1202918 | 0.73 | CASP3 (0.68) | CASP3SENP6SENP8SENP7APAF1 | |
| SCHEMBL30465578 | 0.73 | KDM1A (0.52) | LMNACTSVCTSLKDM4EHPGD |
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-2001055117-A1 | NOVEL ISOQUINOLINE DERIVATIVES, PREPARATION METHOD AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | LES LABORATOIRES SERVIER (FR) | 2001-08-02 | — | — | WO | disclosed |