Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.43 |
| ▸ | RAB9A | P51151 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8044514 | 0.86 | NPC1 (0.39) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8044457 | 0.85 | HDAC6 (0.57) | NPC1RAB9AMAPTGAAALOX15 | |
| SCHEMBL8032973 | 0.82 | CBLB (0.48) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8051066 | 0.82 | RAB9A (0.44) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8033698 | 0.80 | SMN1; SMN2 (0.42) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8032616 | 0.79 | SMN1; SMN2 (0.54) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8045350 | 0.78 | SMN1; SMN2 (0.39) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8042886 | 0.78 | KDM4E (0.44) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8032463 | 0.78 | POLB (0.41) | TP53SMN1; SMN2NPC1RAB9AMAPT | |
| SCHEMBL8034295 | 0.78 | NPC1 (0.42) | TP53SMN1; SMN2NPC1RAB9AMAPT |
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 |