Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 3/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ACLY | P53396 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.34 |
| ▸ | CCKBR | P32239 | 2/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.33 |
| ▸ | CCKAR | P32238 | 2/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.33 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16621983 | 0.90 | IDH1 (0.39) | IDH1RXFP1ACLYSCN1ASCN5A | |
| SCHEMBL9939466 | 0.86 | GRM4 (0.38) | IDH1RXFP1MEN1KMT2AP2RX7 | |
| SCHEMBL9939770 | 0.86 | RXFP1 (0.38) | IDH1RXFP1ROCK2ROCK1EPHX2 | |
| SCHEMBL16621988 | 0.84 | NAMPT (0.40) | ROCK2MEN1ALDH1A1LMNAMAPT | |
| SCHEMBL9938519 | 0.84 | VNN1 (0.37) | IDH1RXFP1ROCK2ROCK1TRPV1 | |
| SCHEMBL9939437 | 0.83 | RXFP1 (0.39) | IDH1RXFP1CCKBRMEN1LMNA | |
| SCHEMBL9939441 | 0.82 | LMNA (0.42) | MEN1ALDH1A1LMNAMAPTKMT2A | |
| SCHEMBL9939678 | 0.82 | ROCK2 (0.41) | RXFP1ROCK2ROCK1VNN1P2RX7 | |
| SCHEMBL9939753 | 0.81 | RXFP1 (0.37) | IDH1RXFP1ACLYMEN1LMNA | |
| SCHEMBL9939474 | 0.79 | NAMPT (0.39) | IDH1TRPV1 |
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-2012078869-A1 | PYRIDONYL GUANIDINE F1F0-ATPASE INHIBITORS AND THERAPEUTIC USES THEREOF | LYCERA CORPORATION (US) | 2012-06-14 | — | — | WO | disclosed |