Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | IDO1 | P14902 | 2/20 | 0.50 |
| ▸ | PLK1 | P53350 | 1/20 | 0.50 |
| ▸ | LPL | P06858 | 1/20 | 0.46 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | HBB | P68871 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.42 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.41 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.41 |
| ▸ | RXRA | P19793 | 1/20 | 0.41 |
| ▸ | RXRB | P28702 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10606092 | 0.91 | TP53 (0.54) | ALDH1A1SMN1; SMN2IDO1PLK1LPL | |
| SCHEMBL13295554 | 0.85 | TSHR (0.70) | ALDH1A1SMN1; SMN2IDO1PLK1CYP3A4 | |
| SCHEMBL24815652 | 0.84 | PRSS1 (0.50) | ALDH1A1SMN1; SMN2IDO1PLK1ALOX15 | |
| SCHEMBL10308978 | 0.82 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2IDO1PLK1LPL | |
| SCHEMBL1696572 | 0.80 | PRSS1 (0.64) | ALDH1A1SMN1; SMN2IDO1NQO2PLAU | |
| SCHEMBL13944771 | 0.80 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2IDO1PLK1LPL | |
| Hydrochloric Acid SCHEMBL11567719 | 0.78 | PRSS1 (0.61) | ALDH1A1SMN1; SMN2IDO1NQO2PLAU | |
| SCHEMBL22084114 | 0.77 | PLK1 (0.53) | ALDH1A1SMN1; SMN2IDO1PLK1LPL | |
| SCHEMBL13455846 | 0.77 | ALDH1A1 (0.48) | ALDH1A1SMN1; SMN2IDO1PLK1LPL | |
| SCHEMBL18975457 | 0.77 | PLK1 (0.59) | ALDH1A1SMN1; SMN2IDO1PLK1LPL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6890377-B2 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2005-05-10 | — | — | US | disclosed |
| US-20040089199-A1 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-13 | — | — | US | disclosed |
| US-6486319-B1 | Thermochromic rylene dyes | BASF AKTIENGESELLSCHAFT (DE) | 2002-11-26 | — | — | US | disclosed |