Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.59 |
| ▸ | ACAT1 | P24752 | 1/20 | 0.56 |
| ▸ | SMPD1 | P17405 | 4/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | TSHR | P16473 | 1/20 | 0.54 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL10839811 | 0.86 | SMPD1 (0.73) | THRASMPD1TP53TSHR | |
| SCHEMBL10840940 | 0.86 | SMPD1 (0.73) | THRASMPD1TP53TSHR | |
| SCHEMBL10839296 | 0.86 | SMPD1 (0.73) | THRASMPD1TP53TSHR | |
| SCHEMBL10840947 | 0.86 | SMPD1 (0.73) | THRASMPD1TP53TSHR | |
| SCHEMBL8884044 | 0.85 | THRA (0.58) | THRASMPD1TP53TSHRPLA2G4B | |
| SCHEMBL7271669 | 0.83 | TP53 (0.77) | THRATP53TSHRPLA2G4B | |
| SCHEMBL14672324 | 0.83 | TP53 (0.77) | THRATP53TSHRPLA2G4B | |
| SCHEMBL5383674 | 0.83 | TP53 (0.77) | THRATP53TSHRPLA2G4B | |
| SCHEMBL28570651 | 0.83 | NPC1 (0.68) | ACAT1TP53TSHRMEN1NPC1 | |
| SCHEMBL5388136 | 0.83 | TP53 (0.77) | THRATP53TSHRPLA2G4B |
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-11158135-A | — | — | None | — | — | JP | disclosed |
| JP-H11158135-A | NAPHTHALENE COMPOUND, LIQUID CRYSTAL COMPOSITION AND LIQUID CRYSTAL ELEMENT | MITSUI CHEM INC | 1999-06-15 | — | — | JP | disclosed |