Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.42 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.42 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.42 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.38 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | HTR5A | P47898 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 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 | |
|---|---|---|---|---|
| SCHEMBL1445116 | 0.85 | MEN1 (0.41) | ALDH1A1SMN1; SMN2MEN1KMT2ANPSR1 | |
| SCHEMBL19111959 | 0.85 | MEN1 (0.41) | ALDH1A1SMN1; SMN2MEN1KMT2ANPSR1 | |
| SCHEMBL23146418 | 0.82 | CHRM2 (0.38) | ALDH1A1L3MBTL1CHRM2CHRM4CHRM5 | |
| SCHEMBL23146225 | 0.82 | CHRM2 (0.38) | ALDH1A1L3MBTL1CHRM2CHRM4CHRM5 | |
| SCHEMBL8485 | 0.81 | SLC6A2 (0.42) | ALDH1A1CHRM2CHRM4CHRM5CHRM3 | |
| Ammonia Solution, Strong SCHEMBL27469603 | 0.80 | SLC6A2 (0.41) | ALDH1A1CHRM2CHRM4CHRM5CHRM3 | |
| Hydrochloric Acid SCHEMBL12503316 | 0.80 | KDM4E (0.41) | ALDH1A1CHRM2CHRM4CHRM5CHRM3 | |
| SCHEMBL14062638 | 0.79 | S1PR1 (0.39) | ALDH1A1SMN1; SMN2MEN1KMT2ANPSR1 | |
| SCHEMBL7872545 | 0.79 | CHRM2 (0.37) | ALDH1A1L3MBTL1CHRM2CHRM4CHRM5 | |
| SCHEMBL23146295 | 0.78 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1CHRM2CHRM4CHRM5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3131897-A1 | FACTOR IXA INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2017-02-22 | — | — | EP | disclosed |
| EP-3131896-A1 | FACTOR IXA INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2017-02-22 | — | — | EP | disclosed |
| WO-2015160634-A1 | FACTOR IXA INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-10-22 | — | — | WO | disclosed |
| WO-2015160636-A1 | FACTOR IXA INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2015-10-22 | — | — | WO | disclosed |
| WO-2007053352-A2 | PYRROLOQUINOLINONE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS | WYETH (US) | 2007-05-10 | — | — | WO | disclosed |