Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.39 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.39 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.39 |
| ▸ | ALOX5 | P09917 | 3/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28722247 | 1.00 | CACNA1F (0.39) | CACNA1FABCB1CACNA1DCACNA1SCACNA1C | |
| SCHEMBL28722010 | 0.91 | HDAC3 (0.39) | ALDH1A1SMYD3KMT2AHDAC3HDAC1 | |
| SCHEMBL29452602 | 0.91 | HDAC3 (0.39) | ALDH1A1SMYD3KMT2AHDAC3HDAC1 | |
| SCHEMBL28722012 | 0.91 | HDAC3 (0.39) | ALDH1A1SMYD3KMT2AHDAC3HDAC1 | |
| SCHEMBL23041481 | 0.84 | ALOX5 (0.49) | CACNA1FABCB1CACNA1DCACNA1SCACNA1C | |
| SCHEMBL23052268 | 0.75 | SLC8A1 (0.36) | RAB9AALDH1A1SMYD3SMN1; SMN2KDM4E | |
| SCHEMBL23052252 | 0.75 | SLC8A1 (0.36) | RAB9AALDH1A1SMYD3SMN1; SMN2KDM4E | |
| SCHEMBL23052251 | 0.75 | SLC8A1 (0.36) | RAB9AALDH1A1SMYD3SMN1; SMN2KDM4E | |
| SCHEMBL23052269 | 0.75 | SLC8A1 (0.36) | RAB9AALDH1A1SMYD3SMN1; SMN2KDM4E | |
| SCHEMBL29452759 | 0.75 | SLC8A1 (0.36) | RAB9AALDH1A1SMYD3SMN1; SMN2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-114341132-A | Substituted 1, 3-phenylheteroaryl derivatives and their use in the treatment of diseases | 诺华股份有限公司 | 2022-04-12 | — | — | CN | disclosed |