Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | MAOB | P27338 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9640284 | 0.81 | CHRM2 (0.46) | KMT2AMEN1 | |
| Hydrochloric Acid SCHEMBL27389324 | 0.77 | KDM4E (0.40) | RECQLKMT2ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL1851579 | 0.76 | KMT2A (0.39) | KMT2AMAPTMEN1ALDH1A1 | |
| SCHEMBL5787516 | 0.75 | ATM (0.41) | NPC1RAB9AKMT2ATSHRMAPT | |
| SCHEMBL467252 | 0.74 | CYP1A2 (0.45) | KMT2ASMN1; SMN2TSHRNPSR1MEN1 | |
| SCHEMBL6017223 | 0.73 | CYP2D6 (0.46) | KMT2ATSHRMEN1CYP1A2CYP2C19 | |
| SCHEMBL5790059 | 0.72 | ALDH1A1 (0.40) | KMT2ASMN1; SMN2TSHRMAPTMAPK1 | |
| Hydrochloric Acid SCHEMBL9373976 | 0.72 | CNR2 (0.37) | NPC1RAB9ASMN1; SMN2ALDH1A1 | |
| SCHEMBL21219851 | 0.72 | HTR3E (0.54) | NPC1RAB9ARECQLKMT2ASMN1; SMN2 | |
| SCHEMBL8860177 | 0.71 | SLC6A9 (0.39) | KMT2ASMN1; SMN2CYP3A4MEN1CYP1A2 |
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-2008098329-A2 | PHARMACEUTICAL COMPOSITION, PHARMACEUTICAL PRODUCT, OBTAINING PROCESSES OF PHARMACEUTICAL COMPOUNDS AND USE OF SUCH COMPOUNDS FOR TREATING ERECTILE DYSFUNCTION | ACHÉ LABORATÓRIOS FARMACÊUTICOS S/A (BR) | 2008-08-21 | — | — | WO | disclosed |