Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7329235 | 0.81 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNACYP3A4CYP2D6 | |
| SCHEMBL7329079 | 0.81 | DAGLA (0.44) | ALDH1A1PIN1SMN1; SMN2NPC1RAB9A | |
| Acetic Acid Methyl Ester SCHEMBL28399077 | 0.67 | POLB (0.61) | ALDH1A1MAPTLMNASMN1; SMN2HSD17B10 | |
| Sulfuric Acid SCHEMBL11014852 | 0.65 | POLB (0.67) | ALDH1A1MAPTLMNASMN1; SMN2KDM4E | |
| SCHEMBL5858591 | 0.64 | POLB (0.69) | ALDH1A1MAPTLMNASMN1; SMN2KMT2A | |
| Bicarbonate SCHEMBL28244886 | 0.64 | POLB (0.68) | ALDH1A1MAPTSMN1; SMN2CYP2C9POLB | |
| SCHEMBL5604046 | 0.64 | CA12 (0.56) | ALDH1A1MEN1CYP2C9CYP2C19KMT2A | |
| SCHEMBL30823858 | 0.64 | POLB (0.83) | ALDH1A1SMN1; SMN2POLBNPC1RAB9A | |
| SCHEMBL170803 | 0.64 | POLB (0.83) | ALDH1A1SMN1; SMN2POLBNPC1RAB9A | |
| SCHEMBL7376677 | 0.63 | KCNA5 (0.67) | MAPTMEN1KMT2A |
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 |