Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | FLT4 | P35916 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17085840 | 0.85 | TDP1 (0.46) | TDP1TP53NFE2L2KMT2AHTT | |
| SCHEMBL2107802 | 0.83 | PRSS1 (0.48) | TDP1TP53NFE2L2KMT2AHTT | |
| SCHEMBL10604639 | 0.83 | NFE2L2 (0.47) | TDP1TP53CYP3A4CYP2D6TSHR | |
| SCHEMBL31369141 | 0.82 | LMNA (0.50) | TDP1TP53CYP3A4CYP2C19NFE2L2 | |
| SCHEMBL286054 | 0.82 | LMNA (0.50) | TDP1TP53CYP3A4CYP2C19NFE2L2 | |
| SCHEMBL11304178 | 0.81 | TP53 (0.43) | TDP1TP53NFE2L2KMT2AHTT | |
| SCHEMBL2845035 | 0.81 | TDP1 (0.52) | TDP1TP53NFE2L2KMT2AHTT | |
| SCHEMBL3109467 | 0.80 | SMN1; SMN2 (0.44) | TDP1TP53CYP3A4NFE2L2KMT2A | |
| SCHEMBL4884083 | 0.80 | TP53 (0.41) | TDP1TP53NFE2L2KMT2AHTT | |
| SCHEMBL31231356 | 0.80 | SMN1; SMN2 (0.44) | TDP1TP53CYP3A4NFE2L2KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| 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 |