Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | KIT | P10721 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 2/20 | 0.44 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL30695551 | 0.85 | PLK1 (0.46) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL8568914 | 0.85 | PLK1 (0.46) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL10517292 | 0.83 | GRM5 (0.45) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL109198 | 0.83 | P2RX7 (0.59) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL24571662 | 0.81 | CTSA (0.49) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL13310736 | 0.80 | PARP1 (0.48) | KDM4EL3MBTL1KMT2AKITP2RX7 | |
| SCHEMBL30853475 | 0.80 | SMN1; SMN2 (0.48) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL4605525 | 0.80 | SMN1; SMN2 (0.48) | KDM4EL3MBTL1KMT2AKITFDPS | |
| SCHEMBL28151967 | 0.80 | POLB (0.50) | KDM4EL3MBTL1KMT2AKITNPC1 | |
| SCHEMBL162188 | 0.80 | L3MBTL1 (0.50) | KDM4EL3MBTL1KMT2AP2RX7NPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8742123-B2 | HIV integrase inhibitors from pyridoxine | TAIMED BIOLOGICS, INC. (TW) | 2014-06-03 | — | — | US | disclosed |
| WO-2004110351-A2 | HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS | ANADYS PHARMACEUTICALS, INC. (US) | 2004-12-23 | — | — | WO | disclosed |