Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | HTT | P42858 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 4/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | CASP3 | P42574 | 2/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 2/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1897752 | 0.91 | SMN1; SMN2 (0.52) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL1953935 | 0.87 | CASP3 (0.53) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL1952338 | 0.83 | SMN1; SMN2 (0.53) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL2776181 | 0.78 | ANO1 (0.44) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL15241643 | 0.78 | TP53 (0.46) | ALDH1A1HTTSMN1; SMN2TP53RAB9A | |
| SCHEMBL1953704 | 0.78 | ANO1 (0.59) | SMN1; SMN2TP53ANO1 | |
| SCHEMBL1954819 | 0.77 | MEN1 (0.56) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL1952289 | 0.76 | ANO1 (0.57) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL12271436 | 0.76 | CASP3 (0.67) | ALDH1A1HTTMAPTLMNANPSR1 | |
| SCHEMBL1951875 | 0.75 | MEN1 (0.54) | ALDH1A1HTTMAPTLMNANPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2321303-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | Calcimedica, Inc. (US) | 2011-05-18 | — | — | EP | disclosed |
| WO-2010027875-A2 | COMPOUNDS THAT MODULATE INTRACELLULAR CALCIUM | CALCIMEDICA INC. (US) | 2010-03-11 | — | — | WO | disclosed |