Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A3 | O75751 | 1/20 | 0.57 |
| ▸ | HIF1A | Q16665 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | ADRB2 | P07550 | 5/20 | 0.52 |
| ▸ | MAPT | P10636 | 5/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.52 |
| ▸ | TSHR | P16473 | 4/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.52 |
| ▸ | MTOR | P42345 | 2/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11524503 | 0.88 | SLC22A3 (0.53) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| Diacetylisoproterenol SCHEMBL11277673 | 0.87 | SLC22A3 (0.58) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| SCHEMBL23337952 | 0.86 | HIF1A (0.71) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| SCHEMBL11290671 | 0.84 | ALOX15 (0.48) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| Diacetylisoproterenol SCHEMBL11287902 | 0.84 | SLC22A3 (0.54) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| SCHEMBL11526980 | 0.84 | HIF1A (0.76) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| SCHEMBL11287900 | 0.83 | TSHR (0.51) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL3207428 | 0.83 | ADRB2 (0.77) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| Hydrochloric Acid SCHEMBL11287896 | 0.82 | HIF1A (0.50) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 | |
| SCHEMBL11527878 | 0.82 | ADRB2 (0.52) | SLC22A3HIF1ALMNACYP3A4ALDH1A1 |
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-4336400-A | BRONCHODILATOR AGENTS, CARDIOVASCULAR STIMULANTS | STERLING DRUG INC. (US) | 1982-06-22 | — | — | US | disclosed |
| US-4138581-A | BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS | STERLING DRUGS INC. (US) | 1979-02-06 | — | — | US | disclosed |