Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 3/20 | 0.35 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | IL1B | P01584 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL27474220 | 0.77 | MCL1 (0.43) | P2RX7CNR1CNR2IL1B | |
| SCHEMBL27552395 | 0.77 | KCNA3 (0.33) | PTGDR2MEN1POLBKMT2A | |
| SCHEMBL27474749 | 0.76 | CNR1 (0.46) | P2RX7CNR1CNR2 | |
| SCHEMBL27552399 | 0.74 | PDE4A (0.30) | — | |
| SCHEMBL27532991 | 0.72 | MEN1 (0.31) | MEN1POLBKMT2A | |
| SCHEMBL28294127 | 0.72 | SMN1; SMN2 (0.41) | MEN1POLBKMT2A | |
| SCHEMBL27552406 | 0.72 | SMN1; SMN2 (0.34) | MEN1POLBKMT2A | |
| SCHEMBL27552393 | 0.71 | ENPP2 (0.33) | — | |
| SCHEMBL27487624 | 0.70 | HTR2A (0.36) | MEN1KMT2ACNR1CNR2 | |
| SCHEMBL8460681 | 0.66 | CYP1A2 (0.52) | P2RX7MEN1KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-100418968-C | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2008-09-17 | — | — | CN | disclosed |
| CN-1289499-C | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2006-12-13 | — | — | CN | disclosed |
| CN-1837207-A | Pirazino(aza)indole derivatives | VERNALIS RES LTD (GB) | 2006-09-27 | — | — | CN | disclosed |
| CN-1337963-A | Pyrazino (aza) indole derivatives | VERNALIS RES LTD (GB) | 2002-02-27 | — | — | CN | disclosed |