Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | XBP1 | P17861 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1489173 | 0.89 | CASP1 (0.44) | CASP1ALDH1A1HTTNPC1TP53 | |
| SCHEMBL1585724 | 0.85 | AURKA (0.49) | CASP1ALDH1A1HTTNPC1TP53 | |
| SCHEMBL26983369 | 0.85 | RXFP1 (0.53) | CASP1ALDH1A1HTTNPC1TP53 | |
| SCHEMBL3514549 | 0.84 | CA12 (0.42) | ALDH1A1MAPTKDM4ECA1CA2 | |
| SCHEMBL3587766 | 0.81 | KMT2A (0.63) | ALDH1A1NPC1KMT2ALMNAMEN1 | |
| SCHEMBL3983100 | 0.80 | ALDH1A1 (0.49) | CASP1ALDH1A1HTTNPC1MAPT | |
| SCHEMBL3582809 | 0.80 | CASP1 (0.49) | CASP1ALDH1A1MAPK1KDM4ECA1 | |
| SCHEMBL15390858 | 0.79 | CASP1 (0.46) | CASP1ALDH1A1HTTKDM4ECA1 | |
| SCHEMBL3515399 | 0.79 | KDM4E (0.56) | ALDH1A1HTTNPC1TP53MAPT | |
| SCHEMBL8627488 | 0.79 | CYP4F2 (0.50) | CASP1ALDH1A1HTTMAPTMAPK1 |
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-6831074-B2 | Inhibitors of cyclic guanosine 3',5'-monophosphate phosphodiesterases (cGMP PDES); for use in therapy of sexual disorders | PFIZER INC | 2004-12-14 | — | — | US | disclosed |