Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | HPGD | P15428 | 6/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | FBP1 | P09467 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | MC5R | P33032 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8046562 | 0.82 | ALDH1A1 (0.70) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8044849 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8044135 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8042685 | 0.82 | NFKB1 (0.42) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8048346 | 0.81 | HSP90AA1 (0.40) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8046744 | 0.81 | ALDH1A1 (0.48) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8044412 | 0.81 | SMN1; SMN2 (0.44) | ALDH1A1HPGDL3MBTL1RAB9ASMN1; SMN2 | |
| SCHEMBL8043163 | 0.81 | PDK1 (0.52) | ALDH1A1HPGDTSHRRAB9ASMN1; SMN2 | |
| SCHEMBL8048145 | 0.80 | ALDH1A1 (0.55) | ALDH1A1HPGDL3MBTL1TSHRRAB9A | |
| SCHEMBL8033225 | 0.80 | ALDH1A1 (0.47) | ALDH1A1HPGDL3MBTL1TSHRRAB9A |
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 |