Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 6/20 | 0.56 |
| ▸ | RAB9A | P51151 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL6829196 | 0.85 | GAA (0.57) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL7129363 | 0.85 | RAB9A (0.52) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL6829504 | 0.83 | SMN1; SMN2 (0.55) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL7065300 | 0.82 | MAPT (0.69) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL6829694 | 0.82 | MEN1 (0.56) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL6826491 | 0.76 | TERT (0.60) | — | |
| SCHEMBL6925421 | 0.75 | GRM4 (0.59) | GRM4RAB9AMEN1KMT2AKDM4E | |
| SCHEMBL6829771 | 0.74 | NPC1 (0.50) | RAB9AMEN1KMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL6829063 | 0.73 | MEN1 (0.60) | RAB9AMEN1KMT2ASMN1; SMN2TSHR | |
| SCHEMBL7193667 | 0.73 | KMT2A (0.55) | RAB9AMEN1KMT2ASMN1; SMN2NPC1 |
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-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |