Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.33 |
| ▸ | TUBB | P07437 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8324738 | 0.89 | CYP1A2 (0.34) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8324480 | 0.88 | NR4A2 (0.41) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8323736 | 0.85 | NPSR1 (0.41) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8327960 | 0.83 | RAB9A (0.43) | CYP1A2CYP3A4CYP2C19LMNAKMT2A | |
| SCHEMBL8318842 | 0.79 | CYP3A4 (0.35) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8318840 | 0.79 | CYP3A4 (0.35) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8322152 | 0.79 | LMNA (0.44) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8318534 | 0.78 | KDM4E (0.46) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E | |
| SCHEMBL8320338 | 0.78 | RAB9A (0.44) | CYP1A2CYP2C19LMNAALDH1A1GAA | |
| SCHEMBL8324886 | 0.77 | CYP1A2 (0.40) | CYP1A2CYP3A4CYP2C19NR4A2KDM4E |
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-5866594-A | Indole-2-carboxylate derivatives and fungicidal compositions for agricultural or horticultural use containing the derivatives as active component | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1999-02-02 | — | — | US | disclosed |
| EP-0791582-A1 | INDOLE-2-CARBOXYLIC ESTER DERIVATIVES AND AGRICULTURAL AND HORTICULTURAL BACTERIOCIDES CONTAINING THE SAME AS THE ACTIVE INGREDIENT | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1997-08-27 | — | — | EP | disclosed |