Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.37 |
| ▸ | MMP1 | P03956 | 3/20 | 0.37 |
| ▸ | MMP2 | P08253 | 3/20 | 0.37 |
| ▸ | MMP9 | P14780 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 2/20 | 0.36 |
| ▸ | PTAFR | P25105 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4264446 | 1.00 | ALDH1A1 (0.44) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4272704 | 0.83 | SMN1; SMN2 (0.47) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4266209 | 0.82 | EGFR (0.55) | KMT2AHPGDMAPTLMNAHTT | |
| SCHEMBL4267886 | 0.82 | ALDH1A1 (0.47) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4265225 | 0.82 | SMN1; SMN2 (0.46) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4270374 | 0.81 | MITF (0.47) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4273945 | 0.81 | MITF (0.47) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| SCHEMBL4273001 | 0.81 | CYP1A2 (0.37) | ALDH1A1MEN1KMT2ALMNABACE1 | |
| SCHEMBL4274751 | 0.74 | MEN1 (0.45) | ALDH1A1MEN1KMT2AKDM4EHPGD | |
| Pyrrolidine SCHEMBL4264339 | 0.74 | MITF (0.41) | ALDH1A1MEN1KMT2AKDM4EHPGD |
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-2009110002-A1 | NOVEL EFFLUX PUMP INHIBITORS | COUNCIL OF SCIENTIFIC & INDUSTRIAL RESEARCH (IN) | 2009-09-11 | — | — | WO | disclosed |