Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HMGCR | P04035 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15331250 | 0.85 | PTGDR2 (0.66) | PTGDR2MEN1KMT2ASMN1; SMN2PPARD | |
| SCHEMBL11263623 | 0.82 | KDM4E (0.53) | PTGDR2LMNAKMT2ACYP1A2ALDH1A1 | |
| SCHEMBL16271958 | 0.82 | HMGCR (0.52) | LMNAMEN1KMT2ACYP1A2ALDH1A1 | |
| SCHEMBL8372169 | 0.82 | HMGCR (0.52) | LMNAMEN1KMT2ACYP1A2ALDH1A1 | |
| SCHEMBL5519643 | 0.82 | PTGDR2 (0.50) | PTGDR2LMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL18782458 | 0.81 | DRD2 (0.48) | LMNAKMT2AALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL11274293 | 0.81 | ALDH1A1 (0.55) | PTGDR2LMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL11280545 | 0.81 | HTT (0.51) | PTGDR2LMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL32678021 | 0.81 | PTGDR2 (0.73) | PTGDR2LMNAMEN1KMT2ACYP1A2 | |
| SCHEMBL11280539 | 0.81 | NPC1 (0.61) | PTGDR2LMNAKMT2ACYP1A2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4320061-A | ANTISPASMODIC AGENTS | KALI-CHEMIE PHARMA GMBH (DE) | 1982-03-16 | — | — | US | disclosed |
| US-4279905-A | GASTROINTESTINAL DISORDERS | KALI-CHEMIE PHARMA GMBH (DE) | 1981-07-21 | — | — | US | disclosed |