Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.58 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.57 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.57 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.57 |
| ▸ | PPARG | P37231 | 3/20 | 0.56 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.55 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.54 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.52 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.52 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.52 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL6031200 | 1.00 | MAOB (0.58) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL1131974 | 0.87 | NR1H4 (0.62) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL1131978 | 0.87 | NR1H4 (0.62) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL3888880 | 0.86 | NR4A1 (0.64) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL3888890 | 0.86 | NR4A1 (0.64) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL3888888 | 0.86 | NR4A1 (0.64) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL6029653 | 0.86 | MAOB (0.55) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL6029648 | 0.86 | MAOB (0.55) | MAOBNR4A1NR4A2NR4A3PPARG | |
| SCHEMBL5870890 | 0.83 | MAOB (0.54) | MAOBPARP10ABCG2NPC1RAB9A | |
| SCHEMBL9043616 | 0.81 | MAOB (0.67) | MAOBNR4A1NR4A2NR4A3PARP10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1594846-A1 | BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS | Bayer HealthCare AG (DE) | 2005-11-16 | — | — | EP | disclosed |
| WO-2004069805-A1 | BIS(HETERO)ARYL CARBOXAMIDE DERIVATIVES FOR USE AS PGI2 ANTAGONISTS | BAYER HEALTHCARE AG (DE) | 2004-08-19 | — | — | WO | disclosed |