Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | APAF1 | O14727 | 1/20 | 0.47 |
| ▸ | NSD2 | O96028 | 1/20 | 0.47 |
| ▸ | CASP3 | P42574 | 1/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL7995202 | 0.92 | P2RY14 (0.52) | MAOBRAB9ASMN1; SMN2SRD5A2P2RY14 | |
| SCHEMBL7995165 | 0.83 | CASP3 (0.60) | SMN1; SMN2SRD5A2L3MBTL1APAF1NSD2 | |
| SCHEMBL1445542 | 0.81 | CNR2 (0.67) | MAOBRAB9ASMN1; SMN2NPC1L3MBTL1 | |
| SCHEMBL7991450 | 0.80 | CASP3 (0.65) | RAB9ASMN1; SMN2NPC1SRD5A2L3MBTL1 | |
| SCHEMBL7991616 | 0.79 | CASP3 (0.64) | RAB9ASMN1; SMN2NPC1SRD5A2L3MBTL1 | |
| SCHEMBL23458028 | 0.76 | CASP3 (0.78) | NPC1L3MBTL1APAF1NSD2CASP3 | |
| SCHEMBL7066092 | 0.74 | FLT3 (0.78) | SRD5A2FLT3ALDH1A1KDM4ECYP1A2 | |
| SCHEMBL753230 | 0.74 | LMNA (0.52) | SMN1; SMN2POLBL3MBTL1APAF1NSD2 | |
| SCHEMBL30532926 | 0.73 | ALDH1A1 (0.52) | MAOBRAB9ASMN1; SMN2NPC1SRD5A2 | |
| SCHEMBL7991749 | 0.73 | CASP3 (0.61) | RAB9ASMN1; SMN2NPC1SRD5A2L3MBTL1 |
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 |