Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM5 | P08912 | 1/20 | 0.62 |
| ▸ | NPC1 | O15118 | 3/20 | 0.52 |
| ▸ | RAB9A | P51151 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | G6PC1 | P35575 | 1/20 | 0.50 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18757991 | 0.82 | CHRM5 (0.55) | CHRM5NPC1RAB9AALDH1A1TAAR1 | |
| SCHEMBL23732714 | 0.82 | MAPT (0.56) | CHRM5NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL25731888 | 0.81 | CHRM5 (0.68) | CHRM5NPC1RAB9AALDH1A1TAAR1 | |
| SCHEMBL25731885 | 0.80 | CHRM5 (0.66) | CHRM5NPC1RAB9AALDH1A1TAAR1 | |
| SCHEMBL19441389 | 0.79 | ALDH1A1 (0.60) | NPC1RAB9AALDH1A1MAPTMEN1 | |
| SCHEMBL1654602 | 0.77 | CHRM5 (1.00) | CHRM5NPC1TAAR1CYP1A2CYP3A4 | |
| SCHEMBL16224316 | 0.76 | CHRM5 (0.60) | CHRM5NPC1RAB9AALDH1A1TAAR1 | |
| SCHEMBL23996033 | 0.76 | CHRM5 (0.60) | CHRM5NPC1RAB9AALDH1A1TAAR1 | |
| SCHEMBL17560868 | 0.76 | NPC1 (0.67) | CHRM5NPC1RAB9AALDH1A1MAPT | |
| SCHEMBL19449718 | 0.76 | NPC1 (0.67) | CHRM5NPC1RAB9AALDH1A1MAPT |
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-3362448-B1 | NEW COMPOUNDS INHIBITORS OF THE YAP/TAZ-TEAD INTERACTION AND THEIR USE IN THE TREATMENT OF MALIGNANT MESOTHELIOMA | INVENTIVA (FR) | 2021-08-04 | — | — | EP | disclosed |