Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 1/20 | 0.39 |
| ▸ | PDE2A | O00408 | 1/20 | 0.36 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | METAP1 | P53582 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.35 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL179292 | 0.83 | TRPV1 (0.37) | LMNAKDM4EHSP90AA1MAPTBRD4 | |
| SCHEMBL29724855 | 0.79 | DPP4 (0.36) | LMNAKDM4ETRPV1SMN1; SMN2HTT | |
| SCHEMBL1334085 | 0.79 | LMNA (0.36) | LMNAKDM4EHSP90AA1MAPTBRD4 | |
| SCHEMBL369947 | 0.79 | TRPV1 (0.35) | TRPV1TDP1NFE2L2GRM4 | |
| SCHEMBL3257764 | 0.78 | TDP1 (0.39) | LMNAKDM4EHSP90AA1MAPTBRD4 | |
| SCHEMBL30592740 | 0.78 | TDP1 (0.39) | LMNAKDM4EHSP90AA1MAPTBRD4 | |
| SCHEMBL365596 | 0.77 | SMN1; SMN2 (0.42) | LMNAKDM4ETRPV1SMN1; SMN2CYP3A4 | |
| SCHEMBL30816293 | 0.77 | NOS3 (0.50) | LMNAKDM4EHSP90AA1MAPTSMN1; SMN2 | |
| SCHEMBL5038676 | 0.77 | ALDH1A1 (0.44) | KDM4EMETAP2METAP1SMN1; SMN2CYP3A4 | |
| SCHEMBL130124 | 0.77 | NOS3 (0.50) | LMNAKDM4EHSP90AA1MAPTSMN1; SMN2 |
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-2017051319-A1 | ARYL AND HETEROARYL ETHER COMPOUNDS AS ROR GAMMA MODULATORS | GLENMARK PHARMACEUTICALS S.A. (CH) | 2017-03-30 | — | — | WO | disclosed |