Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.48 |
| ▸ | RAB9A | P51151 | 5/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.48 |
| ▸ | MIF | P14174 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | POLB | P06746 | 3/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | ALPG | P10696 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL8047063 | 0.86 | TSHR (0.51) | CYP3A4KDM4EALDH1A1NPSR1TSHR | |
| SCHEMBL8042695 | 0.85 | CPB1 (0.43) | CYP3A4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL8042411 | 0.85 | KMT2A (0.39) | CYP3A4NPC1RAB9AKDM4EMIF | |
| SCHEMBL8051659 | 0.85 | KMT2A (0.49) | HDAC6CYP3A4NPC1RAB9AKDM4E | |
| SCHEMBL8042697 | 0.84 | ALDH1A1 (0.43) | CYP3A4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL8050842 | 0.84 | HSD17B10 (0.46) | CYP3A4KDM4EALDH1A1POLBNPSR1 | |
| SCHEMBL8047548 | 0.84 | NPSR1 (0.54) | CYP3A4KDM4EALDH1A1NPSR1TSHR | |
| SCHEMBL8042509 | 0.83 | HSD17B10 (0.47) | CYP3A4KDM4EALDH1A1POLBNPSR1 | |
| SCHEMBL8047020 | 0.83 | RECQL (0.47) | CYP3A4NPC1RAB9AKDM4EALDH1A1 | |
| SCHEMBL8047418 | 0.83 | KMT2A (0.38) | HDAC6CYP3A4NPC1RAB9AKDM4E |
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-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |