Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 5/20 | 0.38 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.38 |
| ▸ | PDK3 | Q15120 | 4/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 4/20 | 0.38 |
| ▸ | PIR | O00625 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 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 | |
|---|---|---|---|---|
| SCHEMBL8549581 | 0.83 | PDK2 (0.43) | ALDH1A1HPGDPDK2PDK1PDK3 | |
| SCHEMBL8554148 | 0.82 | EGFR (0.36) | ALDH1A1HPGDSMN1; SMN2PDK2PDK1 | |
| SCHEMBL30041840 | 0.80 | TSHR (0.47) | DRD2ALDH1A1SMN1; SMN2PIRMEN1 | |
| SCHEMBL21818960 | 0.80 | ALDH1A1 (0.59) | ALDH1A1MEN1KMT2ATSHRMAPK1 | |
| SCHEMBL7867810 | 0.80 | TSHR (0.47) | DRD2ALDH1A1SMN1; SMN2PIRMEN1 | |
| SCHEMBL8551575 | 0.78 | DRD4 (0.48) | DRD2ALDH1A1CYP3A4HSD17B10CLK4 | |
| SCHEMBL8256846 | 0.78 | ALDH1A1 (0.61) | ALDH1A1HPGDSMN1; SMN2PDK2PDK1 | |
| SCHEMBL28737571 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HPGDSMN1; SMN2PDK2PDK1 | |
| SCHEMBL22980539 | 0.78 | CA12 (0.45) | ALDH1A1HPGDSMN1; SMN2MEN1KMT2A | |
| SCHEMBL8549874 | 0.78 | MEN1 (0.44) | DRD2ALDH1A1HPGDSMN1; SMN2PIR |
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-1345930-A2 | PHARMACEUTICAL COMPOUNDS | ELI LILLY AND COMPANY (US) | 2003-09-24 | — | — | EP | disclosed |
| WO-2002050067-A2 | PHARMACEUTICAL HETEROCYCLIC COMPOUNDS | ELI LILLY AND COMPANY (US) | 2002-06-27 | — | — | WO | disclosed |