Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.49 |
| ▸ | ELANE | P08246 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Acetic Acid Phenyl Ester SCHEMBL1830444 | 0.86 | ELANE (0.58) | ALDH1A1TSHRKMT2AL3MBTL1ELANE | |
| Acetic Acid Phenyl Ester SCHEMBL28363544 | 0.85 | ELANE (0.50) | ALDH1A1KMT2AL3MBTL1ELANEMAPT | |
| Acetic Acid Phenyl Ester SCHEMBL9772000 | 0.85 | LMNA (0.53) | ALDH1A1KMT2AELANEMAPTGAA | |
| Biphenyl SCHEMBL28797140 | 0.85 | ALDH1A1 (0.68) | ALDH1A1TSHRKMT2AL3MBTL1MAPT | |
| Acetic Acid Phenyl Ester SCHEMBL1865089 | 0.84 | ELANE (0.56) | ALDH1A1TSHRKMT2AELANEMAPT | |
| Toluene SCHEMBL10600132 | 0.83 | ALDH1A1 (0.66) | ALDH1A1TSHRKMT2AMAPTGAA | |
| SCHEMBL1228643 | 0.83 | ALDH1A1 (0.46) | ALDH1A1TSHRKMT2AMAPTSMN1; SMN2 | |
| Acetic Acid Phenyl Ester SCHEMBL19064982 | 0.83 | ELANE (0.47) | ALDH1A1KMT2AL3MBTL1ELANEMAPT | |
| SCHEMBL16732192 | 0.82 | MAPT (0.44) | ALDH1A1TSHRKMT2AMAPTSMN1; SMN2 | |
| O-Xylene SCHEMBL9686891 | 0.81 | ALDH1A1 (0.68) | ALDH1A1TSHRGAASMN1; SMN2THRB |
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-6379400-B1 | DYEING FIBERS, SOLVENT OF WATER OR ALCOHOL AND NITROANILINE DYE | WELLA AKTIENGESELLSCHAFT (DE) | 2002-04-30 | — | — | US | disclosed |