Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GGT1 | P19440 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | PLAAT3 | P53816 | 2/20 | 0.45 |
| ▸ | PLAAT5 | Q96KN8 | 2/20 | 0.45 |
| ▸ | PLAAT2 | Q9NWW9 | 2/20 | 0.45 |
| ▸ | PLAAT4 | Q9UL19 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4560841 | 0.86 | GGT1 (0.67) | GGT1CYP2C9CYP2C19KMT2ACYP2D6 | |
| SCHEMBL27507225 | 0.86 | GGT1 (0.67) | GGT1CYP2C9CYP2C19KMT2ACYP2D6 | |
| SCHEMBL27507226 | 0.86 | GGT1 (0.67) | GGT1CYP2C9CYP2C19KMT2ACYP2D6 | |
| SCHEMBL7140689 | 0.85 | CYP4A11 (0.44) | GGT1CYP2C9CYP2C19ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL7146346 | 0.85 | ALDH1A1 (0.41) | GGT1CYP2C9CYP2C19ALDH1A1CYP1A2 | |
| Hydrochloric Acid SCHEMBL4561906 | 0.84 | GGT1 (0.65) | GGT1CYP2C9CYP2C19KMT2ACYP2D6 | |
| Hydrochloric Acid SCHEMBL7140684 | 0.84 | CYP4A11 (0.43) | GGT1CYP2C9CYP2C19ALDH1A1CYP1A2 | |
| SCHEMBL948526 | 0.78 | S1PR1 (0.60) | GGT1DRD2DRD4DRD3SIGMAR1 | |
| SCHEMBL948527 | 0.78 | S1PR1 (0.60) | GGT1DRD2DRD4DRD3SIGMAR1 | |
| SCHEMBL30063501 | 0.76 | HPGD (0.51) | CYP2C9ALDH1A1CYP1A2LMNACYP2D6 |
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-0951465-A1 | ALPHA-AMINO ACID AMIDES, PREPARATION THEREOF AND THE THERAPEUTICAL USE THEREOF | CHIESI FARMACEUTICI S.p.A. (IT) | 1999-10-27 | — | — | EP | disclosed |
| WO-1998003472-A1 | ALPHA-AMINO ACID AMIDES, PREPARATION THEREOF AND THE THERAPEUTICAL USE THEREOF | CHIESI FARMACEUTICI S.P.A. (IT) | 1998-01-29 | — | — | WO | disclosed |