Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.57 |
| ▸ | TSHR | P16473 | 2/20 | 0.57 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.51 |
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | DGKA | P23743 | 2/20 | 0.44 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.42 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6166639 | 0.98 | ALDH1A1 (0.60) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL6168566 | 0.98 | ALDH1A1 (0.60) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL6594105 | 0.94 | NR1I2 (0.58) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL7238882 | 0.85 | — | — | |
| SCHEMBL27476413 | 0.85 | CYP1A2 (0.70) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| Ethyne SCHEMBL28062407 | 0.83 | CYP1A2 (0.67) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL50610 | 0.82 | CYP1A2 (0.73) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL8570508 | 0.82 | CYP1A2 (0.73) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL15457464 | 0.82 | ALOX15 (0.80) | ALDH1A1TSHRALOX15TDP1CYP3A4 | |
| SCHEMBL15442493 | 0.82 | ALOX15 (0.80) | ALDH1A1TSHRALOX15TDP1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1513841-A1 | 1,6,9,14-TETRASUBSTITUTED TERRYLENE TETRACARBOXYLIC ACID DIIMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2005-03-16 | — | — | EP | disclosed |
| WO-2003104232-A1 | 1,6,9,14-TETRASUBSTITUTED TERRYLENE TETRACARBOXYLIC ACID DIIMIDES | BASF AKTIENGESELLSCHAFT (DE) | 2003-12-18 | — | — | WO | disclosed |