Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 3/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | PKM | P14618 | 3/20 | 0.31 |
| ▸ | POLB | P06746 | 4/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.31 |
| ▸ | MAPT | P10636 | 3/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 2/20 | 0.30 |
| ▸ | NPC1 | O15118 | 2/20 | 0.30 |
| ▸ | RAB9A | P51151 | 2/20 | 0.30 |
| ▸ | RECQL | P46063 | 2/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3694555 | 0.86 | HTR1A (0.33) | HTR1AADRA1DADRA1AADRA1BGAA | |
| SCHEMBL5653940 | 0.84 | KCNH2 (0.39) | ADRA1AALDH1A1KMT2ATDP1MEN1 | |
| SCHEMBL3698321 | 0.76 | HCRTR1 (0.35) | HTR1AADRA1DADRA1AADRA1BHTT | |
| SCHEMBL3697149 | 0.74 | HTR1A (0.35) | HTR1AADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL3688301 | 0.71 | ADORA2A (0.36) | HTR1AADRA1DADRA1AADRA1BGAA | |
| SCHEMBL3687758 | 0.71 | CNR2 (0.33) | HTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL3688107 | 0.70 | KCNH2 (0.47) | ADRA1AALDH1A1KMT2ATDP1MEN1 | |
| SCHEMBL3694553 | 0.70 | KCNH2 (0.47) | ADRA1AALDH1A1KMT2ATDP1MEN1 | |
| SCHEMBL3694994 | 0.70 | — | — | |
| SCHEMBL3687874 | 0.67 | HTR1A (0.34) | HTR1AADRA1DADRA1AADRA1BHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2239260-A1 | Novel compounds with antibacterial activity | Morphochem Aktiengesellschaft Für Kombinatorische Chemie (DE) | 2010-10-13 | — | — | EP | disclosed |