Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | PPARG | P37231 | 1/20 | 0.55 |
| ▸ | NCOA2 | Q15596 | 1/20 | 0.55 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.55 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | TSHR | P16473 | 3/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.39 |
| ▸ | P2RY1 | P47900 | 1/20 | 0.39 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28198399 | 0.83 | DAO (0.54) | HPGDKDM4EPOLBHSD17B10GAA | |
| SCHEMBL70027 | 0.83 | NPSR1 (0.67) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL7257673 | 0.82 | HDAC3 (0.55) | NPSR1LMNAL3MBTL1HPGDTSHR | |
| SCHEMBL28045440 | 0.81 | ALOX15 (0.64) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL23682740 | 0.79 | LMNA (0.48) | NPSR1LMNAL3MBTL1HPGDTSHR | |
| SCHEMBL1235256 | 0.77 | LMNA (0.60) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL1303016 | 0.77 | NPSR1 (0.60) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL1587481 | 0.76 | NPSR1 (0.55) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL27861920 | 0.76 | NPSR1 (0.46) | NPSR1LMNAPPARGNCOA2NCOA1 | |
| SCHEMBL1484339 | 0.75 | L3MBTL1 (0.50) | NPSR1LMNAPPARGNCOA2NCOA1 |
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-2021262693-A1 | METHOTREXATE ANALOGS AND METHODS OF USE | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2021-12-30 | — | — | WO | disclosed |