Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 1/20 | 0.48 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.40 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.40 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.40 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.40 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.40 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.40 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12053317 | 0.73 | GPR35 (0.45) | PKMMEN1KMT2AMAPTHTT | |
| SCHEMBL21438038 | 0.72 | ALDH1A1 (0.51) | PKMMEN1KMT2AMAPTPOLB | |
| SCHEMBL261419 | 0.70 | LMNA (0.42) | PKMHSD17B10CHEK1MEN1KMT2A | |
| SCHEMBL11092358 | 0.70 | ALDH1A1 (0.49) | PKMMEN1KMT2AMAPTHTT | |
| SCHEMBL4296586 | 0.70 | NLRP3 (0.47) | PKMMEN1KMT2AMAPTGAA | |
| SCHEMBL28670364 | 0.69 | PKM (0.54) | PKMHSD17B10MEN1KMT2AGAA | |
| SCHEMBL259656 | 0.68 | ALDH1A1 (0.48) | MEN1KMT2AMAPTPOLBL3MBTL1 | |
| SCHEMBL2394274 | 0.68 | TDP1 (0.58) | MEN1KMT2AMAPTPOLBL3MBTL1 | |
| SCHEMBL16397238 | 0.68 | TDP1 (0.58) | MEN1KMT2AMAPTPOLBL3MBTL1 | |
| SCHEMBL11089795 | 0.68 | ALDH1A1 (0.43) | PKMMEN1KMT2AMAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2166842-A1 | TRICYCLIC ANILIDE HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS | Merck Sharp & Dohme Corp. (US) | 2010-03-31 | — | — | EP | disclosed |
| WO-2008153852-A1 | TRICYCLIC ANILIDE HETEROCYCLIC CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2008-12-18 | — | — | WO | disclosed |