Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.33 |
| ▸ | ACHE | P22303 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | ATP4A | P20648 | 1/20 | 0.32 |
| ▸ | HRH2 | P25021 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL11089117 | 1.00 | ALDH1A1 (0.36) | ALDH1A1NAMPTHTR1AADRA1ASMN1; SMN2 | |
| SCHEMBL11091903 | 0.91 | HTR1A (0.39) | ALDH1A1NAMPTHTR1AADRA1ASMN1; SMN2 | |
| SCHEMBL11091907 | 0.91 | HTR1A (0.39) | ALDH1A1NAMPTHTR1AADRA1ASMN1; SMN2 | |
| SCHEMBL11653772 | 0.86 | ALDH1A1 (0.36) | ALDH1A1ADRA1ASMN1; SMN2BCHEACHE | |
| SCHEMBL11653768 | 0.86 | ALDH1A1 (0.36) | ALDH1A1ADRA1ASMN1; SMN2BCHEACHE | |
| SCHEMBL11083937 | 0.85 | BCHE (0.39) | NAMPTHTR1AADRA1ASMN1; SMN2BCHE | |
| SCHEMBL11083931 | 0.85 | BCHE (0.39) | NAMPTHTR1AADRA1ASMN1; SMN2BCHE | |
| SCHEMBL11362912 | 0.85 | ALDH1A1 (0.39) | ALDH1A1ADRA1ASMN1; SMN2BCHEACHE | |
| SCHEMBL11001565 | 0.85 | ALDH1A1 (0.36) | ALDH1A1ADRA1ASMN1; SMN2BCHEACHE | |
| SCHEMBL11006150 | 0.85 | ALDH1A1 (0.36) | ALDH1A1ADRA1ASMN1; SMN2BCHEACHE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4426526-A | HISTAMINE ANTAGONISTS, ANTIINFLAMMATORY, ANTISECRETORY | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1984-01-17 | — | — | US | disclosed |
| US-4264608-A | HISTAMINE ANTAGONISTS | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1981-04-28 | — | — | US | disclosed |
| US-4215126-A | HISTAMINE H2 BLOCKING | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1980-07-29 | — | — | US | disclosed |
| US-4156727-A | ANTIHISTAMINES | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1979-05-29 | — | — | US | disclosed |
| US-4154838-A | ANTIHISTAMINE | SMITH KLINE & FRENCH LABORATORIES LIMITED (GB) | 1979-05-15 | — | — | US | disclosed |