Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.39 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28522067 | 0.80 | HSD17B10 (0.42) | DDB1CRBNHSD17B10SMN1; SMN2ALDH1A1 | |
| SCHEMBL4775801 | 0.77 | KDM4E (0.42) | GPR119ALDH1A1KDM4EPKM | |
| SCHEMBL15578408 | 0.76 | DDB1 (0.41) | DDB1CRBNSMN1; SMN2GPR119KDM4E | |
| SCHEMBL2462453 | 0.75 | HSD17B10 (0.43) | HSD17B10SMN1; SMN2GPR119ATM | |
| SCHEMBL17234607 | 0.75 | HSD17B10 (0.43) | HSD17B10SMN1; SMN2GPR119ATM | |
| SCHEMBL2462455 | 0.75 | HSD17B10 (0.43) | HSD17B10SMN1; SMN2GPR119ATM | |
| SCHEMBL4870111 | 0.75 | NPC1 (0.35) | DDB1CRBNHSD17B10KDM4EMAPT | |
| SCHEMBL28629106 | 0.74 | MAPT (0.42) | HSD17B10ALDH1A1KDM4EMAPT | |
| SCHEMBL21818827 | 0.74 | MAPT (0.42) | HSD17B10ALDH1A1KDM4EMAPT | |
| SCHEMBL14991589 | 0.73 | DDB1 (0.50) | DDB1CRBNSMN1; SMN2GPR119ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1592689-A4 | 3-AMINO-4-PHENYLBUTANOIC ACID DERIVATIVES AS DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES | MERCK & CO INC (US) | 2008-12-24 | — | — | EP | disclosed |
| EP-1592689-A2 | 3-AMINO-4-PHENYLBUTANOIC ACID DERIVATIVES AS DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES | Merck & Co., Inc. (US) | 2005-11-09 | — | — | EP | disclosed |
| WO-2004069162-A2 | 3-AMINO-4-PHENYLBUTANOIC ACID DERIVATIVES AS DIPEPTIDYL PEPTIDASE INHIBITORS FOR THE TREATMENT OR PREVENTION OF DIABETES | MERCK & CO., INC. (US) | 2004-08-19 | — | — | WO | disclosed |