Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.43 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RXRA | P19793 | 3/20 | 0.40 |
| ▸ | RXRB | P28702 | 3/20 | 0.40 |
| ▸ | RXRG | P48443 | 3/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.40 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6969170 | 0.83 | MEN1 (0.41) | AKR1B1PTGDR2KDM4EALDH1A1MEN1 | |
| SCHEMBL6966777 | 0.78 | MEN1 (0.46) | AKR1B1PTGDR2KDM4EMEN1KMT2A | |
| SCHEMBL6970756 | 0.77 | HDAC6 (0.41) | AKR1B1PTGDR2RXRARXRBRXRG | |
| SCHEMBL6961690 | 0.76 | PTGDR2 (0.42) | AKR1B1PTGDR2MEN1KMT2ANPSR1 | |
| SCHEMBL8345204 | 0.75 | ALOX12 (0.41) | AKR1B1PTGDR2MEN1KMT2ANPSR1 | |
| SCHEMBL6973394 | 0.72 | MEN1 (0.42) | AKR1B1PTGDR2KDM4EALDH1A1MEN1 | |
| SCHEMBL6973927 | 0.71 | TP53 (0.39) | AKR1B1PTGDR2RXRARXRBRXRG | |
| SCHEMBL6967782 | 0.70 | LMNA (0.39) | AKR1B1PTGDR2KDM4EALDH1A1MEN1 | |
| SCHEMBL6975073 | 0.68 | MEN1 (0.46) | AKR1B1PTGDR2KDM4EALDH1A1MEN1 | |
| SCHEMBL80581 | 0.65 | ALDH1A1 (0.67) | ALDH1A1FFAR1MEN1KMT2AFFAR4 |
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-5910506-A | IMIDAZOLE DERIVATIVES, E.G.5-(3,5-DICHLOROPHENYLTHIO)-1,2-DIMETHYL-4-ISOPROPYL-1H-IMIDAZOLE; VIRICIDES; AIDS; NONTOXIC | SHIONOGI & CO., LTD. (JP) | 1999-06-08 | — | — | US | disclosed |