Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 4/20 | 0.58 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.58 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA7 | P43166 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | MMP13 | P45452 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL20119318 | 0.84 | SRD5A1 (0.59) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL20178648 | 0.83 | SRD5A1 (0.58) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL20173807 | 0.81 | SRD5A1 (0.56) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL20119320 | 0.80 | SRD5A1 (0.57) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL20178665 | 0.78 | SRD5A1 (0.56) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL20173809 | 0.76 | SRD5A1 (0.54) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL14305560 | 0.76 | ALDH1A1 (0.58) | SRD5A1SRD5A2MAPTCA12CA1 | |
| SCHEMBL19249618 | 0.75 | CA12 (0.51) | SRD5A1SRD5A2CA12CA1CA2 | |
| SCHEMBL11277835 | 0.75 | SRD5A1 (0.58) | SRD5A1SRD5A2CA12CA1CA2 | |
| SCHEMBL10443684 | 0.74 | CA12 (0.57) | SRD5A1SRD5A2MAPTCA12CA1 |
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-2018081285-A1 | UREA-CONTAINING ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2018-05-03 | — | — | WO | disclosed |