Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | ACSS2 | Q9NR19 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL342226 | 0.77 | ALDH1A1 (0.38) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL19990803 | 0.77 | TSHR (0.52) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL4793126 | 0.77 | CYP2C19 (0.52) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL4887210 | 0.73 | KDM4E (0.48) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL82858 | 0.72 | TSHR (0.35) | TSHRALDH1A1KDM4EHTTKCNN4 | |
| SCHEMBL31078914 | 0.71 | ALDH1A1 (0.38) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL9402727 | 0.70 | ALDH1A1 (0.33) | TSHRALDH1A1HTT | |
| SCHEMBL732832 | 0.70 | ALDH1A1 (0.53) | TSHRALDH1A1KDM4EHTTCYP2C19 | |
| SCHEMBL1064377 | 0.69 | TSHR (0.43) | TSHRALDH1A1KDM4EHTTCYP1A2 | |
| SCHEMBL902761 | 0.69 | ALDH1A1 (0.42) | TSHRALDH1A1KDM4EHTTCYP2C19 |
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-5171800-A | Block copolymerization of vinyl aromatic compounds and conjugated dienes with organoalkalimetal compound; polymerization catalysis | BASF AKTIENGESELLSCHAFT (DE) | 1992-12-15 | — | — | US | disclosed |