Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 5/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 4/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8326595 | 0.85 | HSD17B10 (0.70) | MAPTALDH1A1HSD17B10SMN1; SMN2KDM4E | |
| SCHEMBL28352297 | 0.81 | MAPT (0.72) | GRIN2BMAPTALDH1A1HSD17B10SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL5972474 | 0.79 | TGM2 (0.50) | GRIN2BMAPTALDH1A1HSD17B10SMN1; SMN2 | |
| SCHEMBL12200972 | 0.77 | GAA (0.65) | ALDH1A1SMN1; SMN2KMT2AGAACHRM1 | |
| SCHEMBL5369633 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KMT2AMAPK1TDP1 | |
| SCHEMBL8324238 | 0.76 | GAA (0.67) | MAPTSMN1; SMN2GAACHRM1RAB9A | |
| SCHEMBL8508703 | 0.76 | CHRM1 (0.61) | MAPTALDH1A1HSD17B10SMN1; SMN2KDM4E | |
| Hydrochloric Acid SCHEMBL5369625 | 0.75 | ALDH1A1 (0.58) | ALDH1A1KMT2AMAPK1TDP1 | |
| SCHEMBL7695939 | 0.75 | ALDH1A1 (0.66) | ALDH1A1SMN1; SMN2KMT2AMAPK1LMNA | |
| SCHEMBL711507 | 0.75 | PKM (0.71) | HSD17B10SMN1; SMN2KMT2AGAARAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0767792-A4 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORP (US) | 2002-11-20 | — | — | EP | disclosed |
| US-5977101-A | Benzimidazoles/Imidazoles Linked to a Fibrinogen Receptor Antagonist Template Having Vitronectin Receptor Antagonist Activity | SMITHKLINE BEECHAM CORPORATION (US) | 1999-11-02 | — | — | US | disclosed |
| EP-0767792-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1997-04-16 | — | — | EP | disclosed |
| WO-1996000730-A1 | VITRONECTIN RECEPTOR ANTAGONISTS | SMITHKLINE BEECHAM CORPORATION (US) | 1996-01-11 | — | — | WO | disclosed |