Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.35 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.35 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.34 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.34 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.34 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.34 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.34 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.34 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7832355 | 0.82 | NPC1 (0.47) | KDM4ENPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL7832652 | 0.78 | GSK3B (0.44) | HDAC1HDAC6KDM4ENPC1RAB9A | |
| SCHEMBL4778027 | 0.78 | RAB9A (0.43) | NPC1RAB9ASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL6168851 | 0.77 | RAB9A (0.47) | KDM4ENPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL7839557 | 0.75 | NPC1 (0.51) | HDAC1HDAC6NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL7568236 | 0.75 | CES2 (0.43) | NPC1RAB9ALMNAKDM4CKMT2A | |
| SCHEMBL7622865 | 0.75 | TDP1 (0.50) | KDM4ENPC1RAB9ASMN1; SMN2LMNA | |
| SCHEMBL7846518 | 0.75 | CES2 (0.43) | HDAC1NPC1RAB9AKDM4CKMT2A | |
| SCHEMBL7833284 | 0.71 | KMT2A (0.48) | HDAC1HDAC6KDM4ENPC1RAB9A | |
| SCHEMBL2632670 | 0.71 | HDAC1 (0.56) | HDAC1HDAC6KDM4ESMN1; SMN2KMT2A |
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-2001029003-A1 | PROCESS FOR THE PREPARATION OF 1-(6-METHYLPYRIDIN-3-YL)-2-(4-METHYLTHIOPHENYL)-ETHANONE AND ITS USE IN THE SYNTHESIS OF DIARYLPYRIDINES | ZAMBON GROUP S.P.A. (IT) | 2001-04-26 | — | — | WO | disclosed |