Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 12/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.42 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28441182 | 0.84 | SLC6A4 (0.40) | SIGMAR1MEN1KMT2ACYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL28449996 | 0.83 | SLC6A4 (0.39) | SIGMAR1MEN1KMT2ACYP1A2CYP2D6 | |
| SCHEMBL987820 | 0.78 | MAPT (0.36) | RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL29045567 | 0.78 | MAPT (0.36) | RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL27945894 | 0.78 | MAPT (0.36) | RAB9AMEN1KMT2ACYP3A4 | |
| SCHEMBL28540613 | 0.77 | HTR2A (0.46) | — | |
| SCHEMBL27335146 | 0.76 | SIGMAR1 (0.41) | SIGMAR1TAAR1SLC18A2NPC1RAB9A | |
| SCHEMBL9362036 | 0.74 | EED (0.34) | TAAR1CYP2D6 | |
| SCHEMBL5732886 | 0.73 | NPC1 (0.33) | NPC1RAB9ATSHR | |
| SCHEMBL29057188 | 0.68 | CA1 (0.38) | MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0390762-B1 | New bronchospasmolytic compounds and process for their preparation | DRACO AB (SE) | 1994-01-19 | — | — | EP | disclosed |
| EP-0390762-A1 | New bronchospasmolytic compounds and process for their preparation | Aktiebolaget Draco (SE) | 1990-10-03 | — | — | EP | disclosed |