Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.44 |
| ▸ | CCR5 | P51681 | 2/20 | 0.43 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11286090 | 1.00 | KMT2A (0.44) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11286262 | 0.87 | SLC2A1 (0.40) | KMT2ASLC2A1ALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL11279314 | 0.87 | ADRB3 (0.46) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| Nisbuterol SCHEMBL11286092 | 0.87 | ADRB3 (0.46) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| Nisbuterol SCHEMBL29385412 | 0.84 | KMT2A (0.49) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11284119 | 0.83 | ACHE (0.38) | KMT2AALDH1A1LMNATP53GAA | |
| SCHEMBL11282472 | 0.83 | ADRB2 (0.38) | KMT2AALDH1A1SMN1; SMN2LMNATP53 | |
| SCHEMBL11279308 | 0.83 | KMT2A (0.44) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11286085 | 0.83 | KMT2A (0.44) | KMT2ACCR5SLC2A1ALDH1A1SMN1; SMN2 | |
| SCHEMBL11287414 | 0.83 | TBXA2R (0.37) | KMT2ACCR5ALDH1A1LMNACYP3A4 |
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 4 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 | claimed |
| 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 |