Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 4/20 | 0.47 |
| ▸ | IARS1 | P41252 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.33 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | DBH | P09172 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | MARS1 | P56192 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.31 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.31 |
| ▸ | TUBB | P07437 | 1/20 | 0.31 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.31 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.31 |
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 SCHEMBL11286104 | 0.89 | ELANE (0.48) | ELANEPDE4APDE4BPDE4CPDE4D | |
| Hydrochloric Acid SCHEMBL11290084 | 0.86 | ELANE (0.33) | ELANEIARS1KDM4EDBHGAA | |
| SCHEMBL11282093 | 0.85 | ELANE (0.42) | ELANEKDM4EDBHGAARECQL | |
| SCHEMBL11291256 | 0.80 | ALOX15 (0.47) | — | |
| Hydrochloric Acid SCHEMBL11284024 | 0.80 | TSHR (0.42) | IARS1KDM4EDBHGAARECQL | |
| SCHEMBL11279423 | 0.80 | ELANE (0.48) | ELANEPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL11285994 | 0.79 | ALOX15 (0.46) | IARS1KDM4EDBHGAARECQL | |
| Hydrochloric Acid SCHEMBL11278675 | 0.79 | ELANE (0.47) | ELANEPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL11279715 | 0.77 | ELANE (0.48) | ELANEPDE4APDE4BPDE4CPDE4D | |
| SCHEMBL11306289 | 0.77 | KMT2A (0.49) | ELANEGAAESR1CA1CA2 |
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 3 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-RE30241-E | BRONCHODILATION, ADRENERGIC STIMULANTS | STERLING DRUG INC. (US) | 1980-03-25 | — | — | US | disclosed |
| US-4138581-A | BRONCHODILATOR AGENTS, ADRENERGIC STIMULANTS | STERLING DRUGS INC. (US) | 1979-02-06 | — | — | US | disclosed |