Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | P2RY12 | Q9H244 | 1/20 | 0.41 |
| ▸ | PRKCA | P17252 | 2/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12256155 | 0.89 | HDAC6 (0.40) | PKMNPC1RAB9ASMN1; SMN2NFKB1 | |
| SCHEMBL20833643 | 0.89 | NPC1 (0.49) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL2388881 | 0.89 | NPC1 (0.49) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL2391593 | 0.88 | NPC1 (0.50) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL21180772 | 0.77 | P2RY12 (0.41) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL20833589 | 0.77 | HDAC1 (0.42) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL2391009 | 0.76 | HDAC1 (0.48) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL12256182 | 0.76 | HDAC1 (0.48) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL12307070 | 0.76 | HDAC1 (0.48) | PKMNPC1RAB9AMAPTSMN1; SMN2 | |
| SCHEMBL27016029 | 0.76 | HDAC1 (0.48) | PKMNPC1RAB9AMAPTSMN1; 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 |
|---|---|---|---|---|---|---|---|
| US-8017599-B2 | Sequence selective pyrrole and imidazole polyamide metallocomplexes | UNIVERSITY OF WESTERN SYDNEY (AU) | 2011-09-13 | — | — | US | disclosed |