Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 3/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.35 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 4/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.35 |
| ▸ | PTGER2 | P43116 | 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 | |
|---|---|---|---|---|
| SCHEMBL3732787 | 0.88 | FFAR1 (0.43) | FFAR4FFAR1ADORA2AADORA1TSHR | |
| SCHEMBL3746249 | 0.82 | FFAR1 (0.50) | FFAR4FFAR1TSHRNPSR1PTGDR2 | |
| SCHEMBL3746992 | 0.79 | CYP2C19 (0.50) | FFAR4FFAR1CYP2C19NPSR1PTGDR2 | |
| SCHEMBL9284366 | 0.79 | DPP4 (0.50) | FFAR4FFAR1ADRA2CMEN1KMT2A | |
| SCHEMBL9184322 | 0.72 | MEN1 (0.43) | FFAR4FFAR1TSHRMEN1KMT2A | |
| SCHEMBL27840283 | 0.72 | DPP4 (0.58) | FFAR4FFAR1KMT2ATDP1PTGER1 | |
| SCHEMBL429540 | 0.72 | DPP4 (0.58) | FFAR4FFAR1KMT2ATDP1PTGER1 | |
| SCHEMBL7791575 | 0.72 | PTGER1 (0.40) | FFAR4FFAR1TSHRADRA2CMEN1 | |
| SCHEMBL27658164 | 0.71 | DPP4 (0.48) | ADRA2CKMT2APTGER1PTGER4PTGER3 | |
| SCHEMBL554701 | 0.71 | CYP2C19 (0.45) | FFAR4FFAR1CYP2C19ADORA2AADORA1 |
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-1817031-A1 | NOVEL SPECIFIC CASPASE-10 INHIBITORS | Merck Patent GmbH (DE) | 2007-08-15 | — | — | EP | claimed |
| WO-2006058592-A1 | NOVEL SPECIFIC CASPASE-10 INHIBITORS | MERCK PATENT GMBH (DE) | 2006-06-08 | — | — | WO | claimed |