Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.48 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | SRC | P12931 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.40 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1758614 | 0.80 | ALDH1A1 (0.56) | OR51E2ALDH1A1NPSR1HTTLMNA | |
| SCHEMBL1911389 | 0.80 | OR51E2 (0.46) | OR51E2P2RX7ALDH1A1NPSR1HTT | |
| SCHEMBL30996639 | 0.79 | ALDH1A1 (0.58) | OR51E2ALDH1A1HTTCYP1A2CYP2C19 | |
| SCHEMBL1188765 | 0.79 | OR51E2 (0.45) | OR51E2ALDH1A1HTTLMNAPOLB | |
| SCHEMBL9227792 | 0.77 | TDP1 (0.53) | TDP1P2RX7HDAC1HDAC8HDAC6 | |
| SCHEMBL15764263 | 0.77 | TDP1 (0.53) | TDP1P2RX7HDAC1HDAC8HDAC6 | |
| SCHEMBL2203559 | 0.76 | ALDH1A1 (0.56) | OR51E2ALDH1A1HTTCYP1A2LMNA | |
| SCHEMBL5597294 | 0.76 | GAA (0.53) | OR51E2ALDH1A1HTTCYP1A2ERN1 | |
| SCHEMBL24575897 | 0.76 | KMT2A (0.46) | OR51E2ALDH1A1NPSR1HTTLMNA | |
| SCHEMBL16438075 | 0.76 | OR51E2 (0.43) | OR51E2ALDH1A1NPSR1HTTCYP1A2 |
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-1161499-A1 | AZOXY DYES AND THEIR CU COMPLEXES | BASF AKTIENGESELLSCHAFT (DE) | 2001-12-12 | — | — | EP | disclosed |
| WO-2000055259-A1 | AZOXY DYES AND THEIR CU COMPLEXES | BASF AKTIENGESELLSCHAFT (DE) | 2000-09-21 | — | — | WO | disclosed |