Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PREP | P48147 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4594280 | 0.88 | HRH3 (0.48) | ALDH1A1LMNASMN1; SMN2TP53POLB | |
| SCHEMBL6830113 | 0.88 | HRH3 (0.48) | ALDH1A1LMNASMN1; SMN2TP53POLB | |
| SCHEMBL6827794 | 0.85 | TP53 (0.49) | LMNASMN1; SMN2TP53POLBMAPT | |
| SCHEMBL4593356 | 0.84 | TSHR (0.47) | ALDH1A1LMNASMN1; SMN2TP53MAPT | |
| SCHEMBL6825229 | 0.81 | PPARA (0.43) | SMN1; SMN2TP53POLBMAPTMEN1 | |
| SCHEMBL4593456 | 0.80 | DPP4 (0.61) | DPP4 | |
| SCHEMBL4594324 | 0.80 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2TP53POLB | |
| SCHEMBL664125 | 0.80 | DPP4 (0.61) | DPP4 | |
| SCHEMBL4594321 | 0.80 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2TP53POLB | |
| SCHEMBL664742 | 0.79 | DPP4 (0.46) | ALDH1A1LMNASMN1; SMN2TP53POLB |
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-1441719-A1 | N-SUBSTITUTED PYRROLIDIN DERIVATIVES AS DIPEPTIDYL PEPTIDASE IV INHIBITORS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-08-04 | — | — | EP | disclosed |
| WO-2003037327-A1 | N-SUBSTITUTED PYRROLIDIN DERIVATIVES AS DIPEPTIDYL PEPTIDASE IV INHIBITORS | F. HOFFMANN-LA-ROCHE AG (CH) | 2003-05-08 | — | — | WO | disclosed |