Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PMP22 | Q01453 | 1/20 | 0.66 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.62 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.60 |
| ▸ | CASP7 | P55210 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.57 |
| ▸ | CASP1 | P29466 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11671078 | 0.99 | PMP22 (0.64) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL11271070 | 0.99 | PMP22 (0.68) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL11876329 | 0.89 | PMP22 (0.66) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL4884008 | 0.88 | ADRB3 (0.59) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| Colterol SCHEMBL636005 | 0.87 | PMP22 (0.71) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL11670117 | 0.85 | KDM4E (0.64) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL11670188 | 0.83 | ADRB3 (0.67) | PMP22ADRB2HIF1ATSHRCYP1A2 | |
| SCHEMBL11670211 | 0.82 | ADRB2 (0.63) | PMP22ADRB2ADRB1ADRB3 | |
| SCHEMBL11029065 | 0.82 | ADRB3 (0.81) | PMP22ADRB2ADRB3 | |
| Sulfonterol SCHEMBL156925 | 0.82 | PMP22 (0.73) | PMP22ADRB2HIF1ATSHRCYP1A2 |
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-4048229-A | ANTAGONIST ACTIVITY | SMITHKLINE CORPORATION (US) | 1977-09-13 | — | — | US | claimed |
| US-4048229-A | ANTAGONIST ACTIVITY | SMITHKLINE CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |