Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | PYGL | P06737 | 10/20 | 0.49 |
| ▸ | PTGES2 | Q9H7Z7 | 3/20 | 0.45 |
| ▸ | CHAT | P28329 | 1/20 | 0.43 |
| ▸ | GUSB | P08236 | 1/20 | 0.43 |
| ▸ | KDM4A | O75164 | 1/20 | 0.42 |
| ▸ | KDM4B | O94953 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11329653 | 1.00 | ALDH1A1 (0.50) | ALDH1A1PTGS2PYGLPTGES2CHAT | |
| SCHEMBL4620100 | 0.83 | FLT1 (0.44) | ALDH1A1PTGS2PYGLGUSBNPC1 | |
| SCHEMBL3776583 | 0.82 | ALDH1A1 (0.57) | ALDH1A1PTGS2PYGLPTGES2CHAT | |
| SCHEMBL3776586 | 0.82 | ALDH1A1 (0.57) | ALDH1A1PTGS2PYGLPTGES2CHAT | |
| SCHEMBL11343214 | 0.81 | PTGES2 (0.51) | ALDH1A1PTGS2PYGLPTGES2CHAT | |
| SCHEMBL11343211 | 0.81 | PTGES2 (0.51) | ALDH1A1PTGS2PYGLPTGES2CHAT | |
| SCHEMBL5414729 | 0.81 | CA12 (0.42) | ALDH1A1PTGS2PYGLPTGES2GUSB | |
| SCHEMBL5407438 | 0.81 | PTGES2 (0.49) | ALDH1A1PTGS2PYGLPTGES2GUSB | |
| SCHEMBL5411460 | 0.79 | PTGS2 (0.43) | ALDH1A1PTGS2PYGLPTGES2GUSB | |
| SCHEMBL4617952 | 0.78 | CYP1A2 (0.52) | PTGS2PTGES2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4259482-A | NON-SPECIFIC DEPRESSION OF CENTRAL NERVOUS SYSTEM | MEAD JOHNSON & COMPANY (US) | 1981-03-31 | — | — | US | disclosed |
| US-4206142-A | REACTING A STYRYLSULFONYLAMIDINE WITH A BASE | MEAD JOHNSON & COMPANY (US) | 1980-06-03 | — | — | US | disclosed |
| US-4130663-A | ANTITHROMBOGENIC, ANTIHYPERTENSIVE | MEAD JOHNSON & COMPANY (US) | 1978-12-19 | — | — | US | disclosed |
| US-4096183-A | Styrylsulfonylamidines | MEAD JOHNSON & COMPANY (US) | 1978-06-20 | — | — | US | disclosed |
| US-4052455-A | ANALGESICS, BLOOD PLATELET AGGREGATION INHIBITORS | MEAD JOHNSON & COMPANY (US) | 1977-10-04 | — | — | US | disclosed |