Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 5/20 | 0.34 |
| ▸ | HTR7 | P34969 | 5/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 3/20 | 0.33 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | PDCD1 | Q15116 | 2/20 | 0.32 |
| ▸ | CD274 | Q9NZQ7 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.31 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.30 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7603055 | 0.82 | HTR7 (0.37) | HTR1AHTR7DRD2BRD4CYP11B2 | |
| SCHEMBL797677 | 0.80 | HTR1A (0.34) | HTR1AHTR7DRD2PDCD1CD274 | |
| SCHEMBL7607809 | 0.79 | ADRA2C (0.33) | ADRA2C | |
| SCHEMBL17387103 | 0.78 | PDCD1 (0.31) | CHRNB2CHRNA4PDCD1CD274KDM4E | |
| SCHEMBL3672615 | 0.78 | HTR1A (0.35) | HTR1AHTR7DRD2CHRNB2CHRNA4 | |
| SCHEMBL5345743 | 0.77 | HTR1A (0.34) | HTR1AHTR7DRD2CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL5616232 | 0.77 | HTR1A (0.34) | HTR1AHTR7DRD2CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL217236 | 0.77 | PARP10 (0.35) | HTR1AHTR7DRD2CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL217523 | 0.77 | HTR1A (0.36) | HTR1AHTR7DRD2CHRNB2CHRNA4 | |
| SCHEMBL7603235 | 0.75 | — | — |
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-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | claimed |
| US-6410665-B1 | POLYMERIZATION COORDINATION CATALYST FOR ALPHA-OLEFIN | BASELL POLYOLEFINE GMBH (DE) | 2002-06-25 | — | — | US | disclosed |