Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.45 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 3/20 | 0.43 |
| ▸ | NOS1 | P29475 | 3/20 | 0.43 |
| ▸ | NOS2 | P35228 | 3/20 | 0.43 |
| ▸ | SYK | P43405 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 2/20 | 0.41 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.41 |
| ▸ | EHMT1 | Q9H9B1 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19175202 | 0.89 | GAA (0.53) | ABCB1POLBNOS3NOS1NOS2 | |
| SCHEMBL2204177 | 0.81 | MEN1 (0.52) | ABCB1MEN1KMT2ALTA4HKDM4E | |
| SCHEMBL6313608 | 0.79 | KDM4E (0.53) | ABCB1HTR1BPOLBNOS3NOS1 | |
| SCHEMBL4042949 | 0.79 | SLC29A1 (0.50) | ABCB1HTR1BPOLBSYKMEN1 | |
| SCHEMBL15016438 | 0.79 | HTR1B (0.47) | ABCB1HTR1BNOS3NOS1NOS2 | |
| SCHEMBL6314286 | 0.79 | SYK (0.56) | ABCB1HTR1BPOLBSYKMEN1 | |
| SCHEMBL4088385 | 0.78 | SYK (0.59) | POLBSYK | |
| SCHEMBL24179121 | 0.77 | SIGMAR1 (0.48) | POLBNOS3NOS1NOS2MEN1 | |
| SCHEMBL16803350 | 0.77 | HTR1B (0.51) | ABCB1HTR1BPOLBNOS3NOS1 | |
| SCHEMBL12409057 | 0.75 | SMN1; SMN2 (0.57) | ABCB1HTR1BPOLBSYKMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2844642-B1 | COMPOUNDS FOR INHIBITING CELL PROLIFERATION IN EGFR-DRIVEN CANCERS | ARIAD PHARMA INC (US) | 2019-11-13 | — | — | EP | disclosed |