Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.58 |
| ▸ | TP53 | P04637 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.53 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | AKR1C4 | P17516 | 1/20 | 0.52 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.52 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.52 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.52 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL17912412 | 0.95 | TSHR (0.58) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL28503735 | 0.85 | TSHR (0.69) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL5157430 | 0.85 | TSHR (0.69) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL9437154 | 0.84 | POLB (0.45) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL10615730 | 0.84 | SERPINE1 (0.71) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL5495476 | 0.84 | SERPINE1 (0.71) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL27906902 | 0.84 | SERPINE1 (0.71) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL17912406 | 0.84 | TSHR (0.58) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL9699965 | 0.83 | TSHR (0.57) | TSHRMAPK1TP53CYP3A4LMNA | |
| SCHEMBL927276 | 0.83 | CA12 (0.70) | TSHRTP53LMNAALDH1A1ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-11171838-A | — | — | None | — | — | JP | disclosed |
| JP-H11171838-A | SWALLOWTAIL-TYPE LIQUID CRYSTAL COMPOUND | MITSUBISHI GAS CHEM CO INC | 1999-06-29 | — | — | JP | disclosed |