Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 2/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 3/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SCN1A | P35498 | 2/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | SLC16A3 | O15427 | 3/20 | 0.36 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23970600 | 0.98 | ALDH1A1 (0.43) | ALDH1A1LMNADHODHCYP4F2CYP4A11 | |
| SCHEMBL28805247 | 0.86 | TSHR (0.46) | ALDH1A1LMNAKMT2ASCN1ASCN2A | |
| SCHEMBL14333036 | 0.86 | CYP4F2 (0.38) | ALDH1A1DHODHCYP4F2CYP4A11ADRA1A | |
| SCHEMBL23971381 | 0.86 | CYP4F2 (0.38) | CYP4F2CYP4A11ADRA1AADRA1BTDP1 | |
| SCHEMBL3554041 | 0.83 | ALDH1A1 (0.64) | ALDH1A1LMNADHODHCYP4F2CYP4A11 | |
| SCHEMBL3499475 | 0.82 | LMNA (0.44) | ALDH1A1LMNACYP4F2CYP4A11ADRA1A | |
| SCHEMBL5253878 | 0.81 | ALDH1A1 (0.62) | ALDH1A1LMNADHODHCYP4F2CYP4A11 | |
| SCHEMBL2655008 | 0.81 | ALDH1A1 (0.62) | ALDH1A1LMNADHODHCYP4F2CYP4A11 | |
| SCHEMBL5476839 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNAADRA1AADRA1BKMT2A | |
| SCHEMBL5697877 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNADHODHADRA1AADRA1B |
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 |
|---|---|---|---|---|---|---|---|
| US-5081245-A | Selective antitumor agents | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-01-14 | — | — | US | disclosed |
| EP-0356765-A2 | Carboxylic acid derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1990-03-07 | — | — | EP | disclosed |