Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX4 | Q99571 | 7/20 | 0.53 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SCN4A | P35499 | 1/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.34 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.34 |
| ▸ | MYC | P01106 | 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 | |
|---|---|---|---|---|
| SCHEMBL29843231 | 0.85 | ADORA1 (0.43) | P2RX4ADORA3BCHEMEN1KMT2A | |
| SCHEMBL7020595 | 0.84 | BCHE (0.44) | P2RX4BCHEMEN1KMT2AMAPK1 | |
| SCHEMBL30081007 | 0.80 | P2RX4 (0.40) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL7029078 | 0.80 | P2RX4 (0.40) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL28222693 | 0.79 | LMNA (0.39) | P2RX4LMNATSHRMAPK1SCN4A | |
| SCHEMBL28223433 | 0.79 | LMNA (0.49) | P2RX4BCHELMNATSHRMAPK1 | |
| SCHEMBL28222695 | 0.78 | P2RX4 (0.52) | P2RX4ADORA3MEN1KMT2AKDM4E | |
| SCHEMBL28223435 | 0.78 | P2RX4 (0.53) | P2RX4ADORA3KMT2AMAPK1 | |
| SCHEMBL28860614 | 0.76 | P2RX4 (0.49) | P2RX4MEN1KMT2ALMNAMAPK1 | |
| SCHEMBL27822676 | 0.76 | P2RX4 (0.51) | P2RX4BCHEMEN1KMT2AKDM4E |
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-101580505-B | Derivatives of pyrrolo[2,1-b]quinazoline natural products, preparation method and application thereof | UNIV SHENYANG PHARMACEUTICAL | 2014-09-10 | — | — | CN | disclosed |
| CN-101580505-A | Derivatives of pyrrolo[2,1-b]quinazoline natural products, preparation method and application thereof | UNIV SHENYANG PHARMACEUTICAL (CN) | 2009-11-18 | — | — | CN | disclosed |