Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | PREP | P48147 | 7/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 1/20 | 0.40 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.38 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.38 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.38 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3711838 | 0.84 | NAMPT (0.56) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL3704706 | 0.82 | NAMPT (0.55) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL3704195 | 0.82 | NAMPT (0.50) | TSHRNAMPTADORA2AADORA1ATM | |
| SCHEMBL3707477 | 0.80 | NAMPT (0.49) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL3706069 | 0.80 | KDM4E (0.51) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL12398 | 0.80 | KDM4E (0.51) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL3700457 | 0.80 | KDM4E (0.51) | TSHRNAMPTATMKDM4EALDH1A1 | |
| SCHEMBL3698852 | 0.76 | ALDH1A1 (0.51) | NAMPTKDM4EALDH1A1HSD17B10CNR2 | |
| SCHEMBL13812236 | 0.76 | ITGB3 (0.46) | TSHRNAMPTATMDDB1CRBN | |
| SCHEMBL12522667 | 0.76 | NAMPT (0.45) | TSHRNAMPTATMKDM4EALDH1A1 |
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-1635818-B1 | FUSED INDOLES AS DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES | MERCK SHARP & DOHME (US) | 2010-04-07 | — | — | EP | disclosed |
| WO-2004110436-A1 | FUSED INDOLES AS DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES | MERCK & CO., INC. (US) | 2004-12-23 | — | — | WO | disclosed |