Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHMT2 | P34897 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.46 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.46 |
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.41 |
| ▸ | CASP6 | P55212 | 1/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 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 | |
|---|---|---|---|---|
| SCHEMBL14433363 | 0.84 | HDAC1 (0.52) | SHMT2HDAC1PRSS1TPSAB1BACE1 | |
| SCHEMBL855297 | 0.83 | HDAC1 (0.47) | HDAC1PRSS1TPSAB1CACNA1HNPC1 | |
| SCHEMBL3230293 | 0.80 | NPC1 (0.59) | SHMT2HDAC1BACE1LTA4HMAPK14 | |
| SCHEMBL13465238 | 0.78 | SHMT2 (0.54) | SHMT2HDAC1BACE1RAB9ANPC1 | |
| SCHEMBL30689233 | 0.76 | PRSS1 (0.45) | HDAC1PRSS1TPSAB1CACNA1HL3MBTL1 | |
| SCHEMBL30819391 | 0.75 | PRSS1 (0.49) | HDAC1PRSS1TPSAB1CACNA1HL3MBTL1 | |
| SCHEMBL8426730 | 0.75 | PRSS1 (0.56) | PRSS1TPSAB1CACNA1HL3MBTL1RAB9A | |
| SCHEMBL7034814 | 0.75 | HDAC1 (0.52) | HDAC1PRSS1TPSAB1RAB9ANPC1 | |
| SCHEMBL14091122 | 0.73 | CTSK (0.50) | HDAC1PRSS1TPSAB1RAB9ANPC1 | |
| SCHEMBL11517533 | 0.73 | PRSS1 (0.60) | PRSS1TPSAB1CACNA1HRAB9AKMT2A |
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 |