Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAD51 | Q06609 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.37 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | APLNR | P35414 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5331474 | 0.89 | PTGS2 (0.38) | HTTCYP2C9THRBPTGS2CHRNA7 | |
| SCHEMBL14624160 | 0.86 | HTT (0.35) | RAD51HTTCYP2C9THRBPTGS2 | |
| SCHEMBL5326545 | 0.86 | PTGS2 (0.39) | HTTCYP2C9THRBPTGS2CHRNA7 | |
| SCHEMBL5297375 | 0.86 | MEN1 (0.42) | HTTCYP2C9PTGS2CHRNA7LMNA | |
| SCHEMBL14624154 | 0.86 | THRB (0.37) | HTTCYP2C9THRBPTGS2PTGS1 | |
| SCHEMBL5328124 | 0.85 | PTGS2 (0.37) | HTTCYP2C9THRBPTGS2PTGS1 | |
| SCHEMBL5288972 | 0.85 | MEN1 (0.40) | HTTCYP2C9THRBPTGS2CHRNA7 | |
| SCHEMBL5320985 | 0.85 | PTGS2 (0.43) | HTTCYP2C9THRBPTGS2CHRNA7 | |
| SCHEMBL5330480 | 0.84 | THRB (0.36) | HTTCYP2C9THRBPTGS2CHRNA7 | |
| SCHEMBL5326343 | 0.84 | THRB (0.36) | HTTCYP2C9THRBPTGS2PTGS1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007007161-A2 | NOVEL BIO-ACTIVE DERIVATIVES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-01-18 | — | — | WO | claimed |
| WO-2007007161-A2 | NOVEL BIO-ACTIVE DERIVATIVES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-01-18 | — | — | WO | disclosed |
| WO-2007007161-A2 | NOVEL BIO-ACTIVE DERIVATIVES | ORCHID RESEARCH LABORATORIES LIMITED (IN) | 2007-01-18 | — | — | WO | disclosed |