Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.38 |
| ▸ | NPC1 | O15118 | 6/20 | 0.38 |
| ▸ | RAB9A | P51151 | 6/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.37 |
| ▸ | RELA | Q04206 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8614253 | 0.99 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2APOLBLMNA | |
| SCHEMBL8621464 | 0.93 | ALDH1A1 (0.50) | ALDH1A1MAPTKMT2APOLBLMNA | |
| SCHEMBL8619159 | 0.88 | ALDH1A1 (0.45) | ALDH1A1MAPTKMT2AHPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL8620197 | 0.87 | ALDH1A1 (0.44) | ALDH1A1MAPTKMT2AHPGDSMN1; SMN2 | |
| SCHEMBL8619303 | 0.84 | ALDH1A1 (0.51) | ALDH1A1MAPTKMT2APOLBLMNA | |
| SCHEMBL8618984 | 0.84 | ALDH1A1 (0.54) | ALDH1A1MAPTKMT2APOLBLMNA | |
| Hydrochloric Acid SCHEMBL8620325 | 0.83 | ALDH1A1 (0.53) | ALDH1A1MAPTKMT2APOLBLMNA | |
| SCHEMBL8614877 | 0.83 | ALDH1A1 (0.44) | ALDH1A1MAPTKMT2ALMNAHPGD | |
| SCHEMBL8966758 | 0.82 | CYP2C19 (0.43) | ALDH1A1MAPTKMT2ALMNATSHR | |
| Hydrochloric Acid SCHEMBL8966480 | 0.81 | CYP2C19 (0.42) | ALDH1A1MAPTKMT2ALMNATSHR |
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-5767121-A | ANTIINFLAMMATORY AND -ARTHRITIC AGENTS; ANTIPYRETICS; ANALGESICS; ADHESION PROTEIN EXPRESSION AND CYCLOXYGENASE AND 5-LIPOXYGENASE INHIBITORS; IMMUNOSUPPRESSANTS AND -MODULATORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-06-16 | — | — | US | disclosed |