Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.41 |
| ▸ | FER | P16591 | 1/20 | 0.41 |
| ▸ | LTK | P29376 | 1/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10623745 | 0.89 | GSK3B (0.45) | GSK3BGSK3ACES1MEN1KMT2A | |
| SCHEMBL9471120 | 0.83 | GSK3B (0.37) | GSK3BGSK3ACES1MEN1KMT2A | |
| SCHEMBL8938695 | 0.83 | CES1 (0.41) | GSK3BGSK3ACES1MEN1KMT2A | |
| SCHEMBL10623710 | 0.83 | CSNK1G1 (0.44) | GSK3BGSK3ACES1ACVR1LRRK2 | |
| SCHEMBL10620834 | 0.81 | GSK3B (0.42) | GSK3BGSK3APDGFRAFERLTK | |
| SCHEMBL10621561 | 0.73 | CSNK1G1 (0.42) | GSK3BGSK3AMEN1KMT2AACVR1 | |
| SCHEMBL10621317 | 0.73 | GSK3B (0.44) | GSK3BGSK3ACES1PDGFRAFER | |
| SCHEMBL10623742 | 0.73 | GSK3B (0.39) | GSK3BGSK3AMEN1KMT2APDGFRA | |
| SCHEMBL11453394 | 0.73 | HSD17B3 (0.43) | MEN1KMT2ACA12CA1CA2 | |
| SCHEMBL20267338 | 0.72 | GSK3B (0.55) | GSK3BGSK3AMEN1KMT2AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5536717-A | ANTIDEPRESSANTS, ANALGESICS | HOECHST MARION ROUSSEL INC. (US) | 1996-07-16 | — | — | US | disclosed |
| US-5189161-A | Analgesics | HOECHST ROUSSEL PHARMACEUTICALS INC. (US) | 1993-02-23 | — | — | US | disclosed |
| US-5015738-A | Analgesics | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1991-05-14 | — | — | US | disclosed |
| US-4983601-A | Analgesics | HOECHST-ROUSSEL PHARMACEUTICAL INC. (US) | 1991-01-08 | — | — | US | disclosed |