Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.41 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.41 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.41 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.41 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13820047 | 0.80 | P2RX7 (0.40) | P2RX7MTNR1AMTNR1B | |
| SCHEMBL5376011 | 0.80 | KDM4E (0.52) | ALDH1A1TSHRHPGDLMNAGLA | |
| SCHEMBL21617923 | 0.78 | SMN1; SMN2 (0.51) | GLAKDM4EMAPTMEN1KMT2A | |
| SCHEMBL28947821 | 0.77 | CYP1A2 (0.44) | ALDH1A1TSHRHPGDLMNAGLA | |
| SCHEMBL30009880 | 0.76 | GRIN2D (0.54) | ALDH1A1TSHRHPGDLMNAGLA | |
| SCHEMBL4309213 | 0.76 | GRIN2D (0.54) | ALDH1A1TSHRHPGDLMNAGLA | |
| SCHEMBL27973166 | 0.75 | MPL (0.44) | ALDH1A1TSHRHPGDLMNAGLA | |
| SCHEMBL11741944 | 0.75 | SRC (0.52) | GLAKDM4EGRIN2DGRIN3BGRIN1 | |
| SCHEMBL29322645 | 0.75 | HTR2B (0.40) | TSHRNFKB1NPSR1P2RX7MAPT | |
| SCHEMBL28025050 | 0.75 | P2RX7 (0.46) | ALDH1A1TSHRHPGDLMNAGLA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104854087-A | As P2X7Indole carboxamide derivatives of receptor antagonists | ACTELION PHARMACEUTICALS LTD | 2015-08-19 | — | — | CN | disclosed |
| CN-104812749-A | Iindole carboxamide derivatives as p2x7 receptor antagonists | ACTELION PHARMACEUTICALS LTD | 2015-07-29 | — | — | CN | disclosed |