Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CETP | P11597 | 1/20 | 0.67 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.67 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.67 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.67 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.51 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.51 |
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL28019517 | 0.91 | GAA (0.55) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL28256535 | 0.88 | CETP (0.77) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL28258088 | 0.88 | CETP (0.77) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL12323604 | 0.88 | CETP (0.77) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL19423434 | 0.81 | CETP (0.69) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL28734434 | 0.81 | CETP (0.69) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL6825065 | 0.80 | P2RX7 (0.72) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL13703413 | 0.80 | HDAC3 (0.71) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL13212284 | 0.80 | CETP (1.00) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 | |
| SCHEMBL4223097 | 0.80 | HDAC1 (1.00) | CETPHDAC3HDAC1HDAC2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6399614-B1 | TREATING NEUROMUSCULAR DYSFUNCTION OF LOWER URINARY TRACT VIA PERIPHERAL OR CENTRAL NERVOUS SYSTEM; SEROTONIN RECEPTOR ANTAGONIST | RECORDATI S.A. CHEMICAL AND PHARMACEUTICAL COMPANY (CH) | 2002-06-04 | — | — | US | disclosed |