Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.44 |
| ▸ | FDPS | P14324 | 1/20 | 0.44 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.42 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL1682628 | 0.82 | CYP1A1 (0.58) | ALDH1A1TSHRKDM4ECYP1A1CYP1B1 | |
| SCHEMBL4146840 | 0.80 | MAPT (0.57) | ALDH1A1TSHRKDM4ETDP1GLO1 | |
| SCHEMBL1662997 | 0.79 | ALDH1A1 (0.70) | ALDH1A1TSHRKDM4ETDP1GLO1 | |
| SCHEMBL17345596 | 0.79 | IRAK4 (0.37) | ALDH1A1TSHRGLO1MAPTSMN1; SMN2 | |
| SCHEMBL13562270 | 0.79 | TOP2A (0.44) | ALDH1A1TSHRGLO1 | |
| SCHEMBL5463782 | 0.78 | CYP1A1 (0.67) | ALDH1A1TSHRCYP1A1CYP1B1CYP1A2 | |
| SCHEMBL5463775 | 0.78 | CYP1A1 (0.67) | ALDH1A1TSHRCYP1A1CYP1B1CYP1A2 | |
| SCHEMBL4450324 | 0.76 | IRAK4 (0.41) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP19A1 | |
| SCHEMBL28707673 | 0.76 | IRAK4 (0.41) | ALDH1A1CYP1A1CYP1B1CYP1A2CYP19A1 | |
| SCHEMBL1518763 | 0.76 | ALDH1A1 (0.34) | ALDH1A1TSHRKDM4ETDP1GLO1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114315563-A | Process for producing branched carboxylic acid compound | 常州大学 | 2022-04-12 | — | — | CN | disclosed |