Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 2/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | FNTA | P49354 | 1/20 | 0.37 |
| ▸ | FNTB | P49356 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL366817 | 0.90 | NPC1 (0.39) | NPC1ATMGAARXFP1CYP19A1 | |
| SCHEMBL365175 | 0.89 | NPC1 (0.43) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL366558 | 0.87 | NPC1 (0.42) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL367749 | 0.86 | NPC1 (0.41) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL366789 | 0.84 | IDO1 (0.38) | KDM4EALDH1A1MAPTACLYERN1 | |
| SCHEMBL367733 | 0.82 | KMT2A (0.38) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL366076 | 0.82 | CA12 (0.41) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL365272 | 0.81 | CA12 (0.42) | NPC1ATMGAARXFP1KDM4E | |
| SCHEMBL367204 | 0.79 | RORC (0.43) | GAAKDM4EALDH1A1MAPTFNTA | |
| SCHEMBL367176 | 0.79 | HTR6 (0.38) | KDM4EALDH1A1MAPTIDO1PTGS2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |