Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | PKM | P14618 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | VCAM1 | P19320 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.32 |
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 SCHEMBL11265185 | 0.88 | SMN1; SMN2 (0.47) | THRATHRBSMN1; SMN2PKMNPSR1 | |
| SCHEMBL11267202 | 0.81 | VCAM1 (0.33) | THRATHRBSMN1; SMN2VCAM1ALDH1A1 | |
| SCHEMBL11268049 | 0.81 | ALPL (0.39) | THRATHRBSMN1; SMN2VCAM1SLC9A1 | |
| SCHEMBL2294634 | 0.80 | STS (0.43) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL11281249 | 0.74 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL11281683 | 0.74 | MAPT (0.41) | SMN1; SMN2NPSR1MAPTALDH1A1 | |
| SCHEMBL11281678 | 0.74 | TBXA2R (0.42) | SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL11278709 | 0.73 | TBXA2R (0.43) | SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL11280963 | 0.73 | MAPT (0.39) | THRBMAPTALDH1A1 | |
| SCHEMBL11290594 | 0.72 | ALDH1A1 (0.48) | ALDH1A1 |
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-4327224-A | ADRENERGIC BLOCKING AGENTS | STERLING DRUG INC. (US) | 1982-04-27 | — | — | US | disclosed |
| US-4124722-A | USING AN A-((ALKYLAMINO)ALKYL)-4-HYDROXY-3-(ALKYL-THIO, -SULFINYL -SULFONYL)-BENZENEMETHANOL | STERLING DRUG INC. (US) | 1978-11-07 | — | — | US | disclosed |