Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.55 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.55 |
| ▸ | CCR5 | P51681 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
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 SCHEMBL11848162 | 0.99 | ADRB2 (0.53) | ADRB2ADRB1CCR5ALDH1A1RAB9A | |
| SCHEMBL11849024 | 0.82 | SIGMAR1 (0.48) | ADRB2ADRB1ALDH1A1ADRB3HTT | |
| Hydrochloric Acid SCHEMBL11849017 | 0.81 | SIGMAR1 (0.50) | ADRB2ADRB1ALDH1A1ADRB3HTT | |
| SCHEMBL11850645 | 0.81 | KMT2A (0.50) | ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL11846411 | 0.81 | ADRB2 (0.49) | ADRB2ADRB1CCR5ALDH1A1RAB9A | |
| Hydrochloric Acid SCHEMBL11850641 | 0.80 | KMT2A (0.52) | ALDH1A1MEN1KMT2ASMN1; SMN2KDM4E | |
| SCHEMBL11848510 | 0.75 | MEN1 (0.52) | ADRB2ADRB1ALDH1A1MEN1HTT | |
| Hydrochloric Acid SCHEMBL11848159 | 0.75 | MEN1 (0.40) | ALDH1A1RAB9AMEN1HTTKMT2A | |
| SCHEMBL17833747 | 0.75 | CHRNA7 (0.46) | ALDH1A1RAB9AMEN1HTTKMT2A | |
| Hydrochloric Acid SCHEMBL11848505 | 0.75 | MEN1 (0.53) | ADRB2ALDH1A1MEN1HTTKMT2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3976695-A | Halogen substituted α-(aminoalkyl)-3,4-dihydroxybenzyl alcohols | SMITHKLINE CORPORATION (US) | 1976-08-24 | — | — | US | disclosed |