Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | HSPA5 | P11021 | 6/20 | 0.49 |
| ▸ | HSPA9 | P38646 | 3/20 | 0.47 |
| ▸ | HSPA2 | P54652 | 2/20 | 0.46 |
| ▸ | FFAR2 | O15552 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | XBP1 | P17861 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | ACP1 | P24666 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7868150 | 0.87 | ALDH1A1 (0.51) | SMN1; SMN2HSPA5HSPA9HSPA2FFAR2 | |
| SCHEMBL9072828 | 0.82 | HSPA5 (0.49) | SMN1; SMN2HSPA5HSPA9FFAR2LMNA | |
| SCHEMBL7868117 | 0.80 | NPC1 (0.66) | SMN1; SMN2HSPA5HSPA9HSPA2LMNA | |
| SCHEMBL27228868 | 0.78 | FFAR2 (0.60) | SMN1; SMN2HSPA5HSPA9HSPA2FFAR2 | |
| SCHEMBL5875678 | 0.78 | CYP1A2 (0.62) | SMN1; SMN2HSPA5HSPA2FFAR2LMNA | |
| SCHEMBL7873351 | 0.78 | FFAR2 (0.60) | SMN1; SMN2HSPA5HSPA9HSPA2FFAR2 | |
| SCHEMBL352731 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL17186333 | 0.74 | NPC1 (0.56) | SMN1; SMN2LMNANPC1RAB9AACP1 | |
| Bromide SCHEMBL11317007 | 0.74 | LMNA (0.57) | HSPA5HSPA9HSPA2FFAR2LMNA | |
| SCHEMBL2672708 | 0.73 | EPHX2 (0.60) | FFAR2TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6329400-B1 | INHIBITION OR ANTAGONISM OF MATRIX METALLOPROTEASES, AND/OR TUMOR NECROSIS FACTOR-ALPHA; EXTRACELLULAR MATRIX DEGRADATION, INHIBITION OF SHEDDING OF CELL SURFACE PROTEIN ECTODOMAINS AND CD23 PROTEOLYSIS | GLAXO WELLCOME INC. | 2001-12-11 | — | — | US | disclosed |