Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | MAOA | P21397 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL21647739 | 1.00 | TSHR (0.53) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL17678491 | 0.87 | TSHR (0.51) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL925746 | 0.86 | TSHR (0.54) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL78754 | 0.84 | TSHR (0.62) | TSHRALDH1A1LMNACYP2D6CYP2C9 | |
| SCHEMBL30409299 | 0.84 | TSHR (0.62) | TSHRALDH1A1LMNACYP2D6CYP2C9 | |
| SCHEMBL1934513 | 0.83 | TSHR (0.54) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL9810822 | 0.83 | TSHR (0.57) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL21647759 | 0.82 | TSHR (0.50) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL30408348 | 0.82 | TSHR (0.50) | TSHRALDH1A1LMNAKMT2ACYP2D6 | |
| SCHEMBL81026 | 0.81 | TSHR (0.59) | TSHRALDH1A1LMNAKMT2ACYP2D6 |
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-112513011-B | Benzene derivatives | 小野药品工业株式会社 | 2023-06-16 | — | — | CN | disclosed |