Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 8/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.58 |
| ▸ | HPGD | P15428 | 4/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 6/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.49 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7399378 | 0.94 | HTT (0.59) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL4038925 | 0.85 | MAPT (0.65) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL2086989 | 0.85 | MAPT (0.61) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL1929569 | 0.85 | MAPT (0.58) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL224123 | 0.85 | TDP1 (0.60) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL4045709 | 0.84 | MAPT (0.64) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL1929875 | 0.84 | MAPT (0.60) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL16063141 | 0.83 | ALDH1A1 (0.51) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL2372812 | 0.83 | HTT (0.60) | HTTTDP1MAPTSMN1; SMN2HPGD | |
| SCHEMBL2471335 | 0.83 | HTT (0.60) | HTTTDP1MAPTSMN1; SMN2HPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1648448-A4 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORP (US) | 2009-04-01 | — | — | EP | disclosed |
| EP-1648448-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2006-04-26 | — | — | EP | disclosed |
| WO-2005011681-A1 | CHEMICAL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2005-02-10 | — | — | WO | disclosed |