Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.59 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.59 |
| ▸ | TSHR | P16473 | 2/20 | 0.59 |
| ▸ | MAPT | P10636 | 8/20 | 0.58 |
| ▸ | RAB9A | P51151 | 6/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | HPGD | P15428 | 5/20 | 0.58 |
| ▸ | GAA | P10253 | 3/20 | 0.58 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.58 |
| ▸ | NPC1 | O15118 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.52 |
| ▸ | RELA | Q04206 | 2/20 | 0.52 |
| ▸ | STAT1 | P42224 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | SCN1A | P35498 | 2/20 | 0.51 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL29634336 | 1.00 | ALDH1A1 (0.59) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL8062671 | 0.88 | ALDH1A1 (0.61) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL396552 | 0.85 | TSHR (0.69) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL23689805 | 0.84 | TSHR (0.62) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| Bicarbonate SCHEMBL27449726 | 0.84 | TSHR (0.67) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL27570718 | 0.84 | ALDH1A1 (0.58) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL27424975 | 0.84 | TSHR (0.70) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL28985324 | 0.83 | TSHR (0.61) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL3869093 | 0.83 | TSHR (0.61) | ALDH1A1HSD17B10TSHRMAPTRAB9A | |
| SCHEMBL4505316 | 0.83 | ALDH1A1 (0.56) | ALDH1A1HSD17B10TSHRMAPTSMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1004654-A2 | Adjuvants and methods for raising intracellular calcium ion concentration | Takasago International Corporation (JP) | 2000-05-31 | — | — | EP | claimed |
| EP-1443934-A1 | BENZOTRIAZEPINES AS GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS | JAMES BLACK FOUNDATION LIMITED (GB) | 2004-08-11 | — | — | EP | disclosed |
| WO-2003041714-A1 | BENZOTRIAZEPINES AS GASTRIN AND CHOLECYSTOKININ RECEPTOR LIGANDS | JAMES BLACK FOUNDATION LIMITED (GB) | 2003-05-22 | — | — | WO | disclosed |