Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR5 | P32302 | 3/20 | 0.41 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.35 |
| ▸ | NQO2 | P16083 | 1/20 | 0.34 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.34 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.33 |
| ▸ | AKR1C2 | P52895 | 2/20 | 0.33 |
| ▸ | CDC42 | P60953 | 1/20 | 0.33 |
| ▸ | RAC1 | P63000 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | POLA1 | P09884 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7958197 | 0.92 | SMYD3 (0.35) | CXCR5SMYD3NQO2MTNR1AMTNR1B | |
| SCHEMBL7950122 | 0.90 | CXCR5 (0.39) | CXCR5SMYD3PTGS2PTGS1AKR1C3 | |
| SCHEMBL7958362 | 0.89 | CXCR5 (0.39) | CXCR5SMYD3PTGS2PTGS1AKR1C3 | |
| SCHEMBL7958053 | 0.88 | CXCR5 (0.41) | CXCR5PTGS2PTGS1AKR1C3AKR1C2 | |
| SCHEMBL7958019 | 0.88 | MEN1 (0.39) | CXCR5SMYD3NQO2MTNR1AMTNR1B | |
| SCHEMBL7964342 | 0.88 | CXCR5 (0.38) | CXCR5SMYD3PTGS2PTGS1AKR1C3 | |
| SCHEMBL7949626 | 0.87 | CXCR5 (0.41) | CXCR5LPAR1 | |
| SCHEMBL7960124 | 0.87 | CXCR5 (0.41) | CXCR5LPAR1 | |
| SCHEMBL7960778 | 0.87 | CXCR5 (0.41) | CXCR5LPAR1 | |
| SCHEMBL7964480 | 0.85 | CXCR5 (0.38) | CXCR5SMYD3PTGS2PTGS1AKR1C3 |
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-6172255-B1 | INSECTICIDES; MITICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 2001-01-09 | — | — | US | disclosed |
| US-5830826-A | Alkoxy-alkyl-substituted 1H-3-aryl-pyrrolidine-2, 4-diones used as herbicicides and pesticides | BAYER AKTIENGESELLSCHAFT (DE) | 1998-11-03 | — | — | US | disclosed |