Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | CPT1A | P50416 | 1/20 | 0.46 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | KDR | P35968 | 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 | |
|---|---|---|---|---|
| SCHEMBL16153722 | 0.92 | PTGDR2 (0.51) | PTGDR2TSHRROCK1RAB9ANPC1 | |
| SCHEMBL14979185 | 0.90 | PTGDR2 (0.51) | PTGDR2TSHRROCK1CPT1ACPT1B | |
| SCHEMBL14979170 | 0.86 | NR1H4 (0.56) | PTGDR2TSHRROCK1RAB9ANPC1 | |
| SCHEMBL14979208 | 0.81 | L3MBTL1 (0.52) | PTGDR2RAB9ANPC1HDAC3HDAC1 | |
| SCHEMBL14979173 | 0.78 | CYP1A2 (0.51) | PTGDR2RAB9ANPC1 | |
| SCHEMBL13281112 | 0.77 | TSHR (0.61) | PTGDR2TSHRALOX15 | |
| SCHEMBL16153712 | 0.76 | NR1H4 (0.52) | PTGDR2RAB9ANPC1POLB | |
| SCHEMBL14979194 | 0.76 | PTGDR2 (0.66) | PTGDR2HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL16085839 | 0.74 | PTGDR2 (0.64) | PTGDR2HDAC3HDAC1HDAC2HDAC10 | |
| SCHEMBL10162575 | 0.73 | TRPV1 (0.71) | RAB9ANPC1HDAC2HDAC8HDAC6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013071880-A1 | NITROGEN-CONTAINING FUSED RING COMPOUNDS FOR USE AS CRTH2 ANTAGONISTS | 山东亨利医药科技有限责任公司 (CN) | 2013-05-23 | — | — | WO | disclosed |