Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 5/20 | 0.42 |
| ▸ | CNR1 | P21554 | 4/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | CA9 | Q16790 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13618088 | 0.86 | CA9 (0.42) | CNR2CNR1CYP2C9ALDH1A1TSHR | |
| SCHEMBL13589496 | 0.85 | CNR2 (0.41) | CNR2CNR1CYP2C9ALDH1A1TSHR | |
| SCHEMBL16066899 | 0.83 | CNR2 (0.39) | CNR2CNR1CYP2C9ALDH1A1TSHR | |
| SCHEMBL13617611 | 0.83 | HPGDS (0.42) | CNR2CNR1CYP2C9ALDH1A1TSHR | |
| SCHEMBL30862093 | 0.82 | KDM4E (0.42) | ALDH1A1TSHRKDM4EMEN1KMT2A | |
| SCHEMBL2798225 | 0.81 | MMP1 (0.41) | ALDH1A1MEN1KMT2AMAPTADRB2 | |
| SCHEMBL1205431 | 0.80 | SMN1; SMN2 (0.41) | CNR2CNR1CYP2C9ALDH1A1MEN1 | |
| SCHEMBL13617868 | 0.79 | ADRB2 (0.47) | CYP2C9TSHRKDM4EMEN1KMT2A | |
| SCHEMBL15630202 | 0.78 | ADRB2 (0.43) | CYP2C9TSHRKDM4EMEN1KMT2A | |
| SCHEMBL13617663 | 0.78 | ADRB2 (0.44) | CYP2C9TSHRKDM4EMEN1KMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2014139485-A1 | A METHOD FOR THE PREPARATION OF 5-[(R)-2-(5,6-DIETHYL-INDAN-2-YLAMINO)-L-HYDROXYETHYL]- 8-HYDROXY-(1H)-QUINOLIN-2-ONE (INDACATEROL) | ZENTIVA, K.S. (CZ) | 2014-09-18 | — | — | WO | disclosed |