Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | NQO2 | P16083 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
| ▸ | PRKCI | P41743 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24992253 | 0.77 | NQO2 (0.32) | NQO2 | |
| SCHEMBL1294328 | 0.76 | KDM4E (0.39) | KDM4EMAPTNQO2CYP2A6ALDH1A1 | |
| SCHEMBL18509026 | 0.74 | SCN9A (0.39) | MAPTCYP2A6MEN1KMT2ALMNA | |
| SCHEMBL31607587 | 0.73 | RHEB (0.38) | KDM4EMAPTNQO2CYP2A6ALDH1A1 | |
| SCHEMBL21794742 | 0.73 | PRKCI (0.46) | KDM4EMAPTNQO2TSHRCYP2A6 | |
| SCHEMBL18876115 | 0.73 | KDM4E (0.36) | KDM4EMAPTTDP1NPSR1NQO2 | |
| SCHEMBL18239677 | 0.73 | KDM4E (0.35) | KDM4EMAPTNQO2CYP2A6ALDH1A1 | |
| SCHEMBL16626053 | 0.72 | POLB (0.38) | KDM4EMAPTNQO2TSHRCYP2A6 | |
| SCHEMBL18359174 | 0.71 | PSEN1 (0.43) | KDM4EMAPTTDP1NPSR1MAPK1 | |
| SCHEMBL30262287 | 0.70 | KIF11 (0.41) | KDM4ENQO2CYP2A6HSD11B1 |
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-2017189663-A1 | ISOXAZOLE DERIVATIVES AS FXR AGONISTS AND METHODS OF USE THEREOF | ENANTA PHARMACEUTICALS, INC. (US) | 2017-11-02 | — | — | WO | disclosed |