Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.49 |
| ▸ | MAPT | P10636 | 8/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.49 |
| ▸ | LMNA | P02545 | 4/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.47 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.47 |
| ▸ | RELA | Q04206 | 1/20 | 0.47 |
| ▸ | TTR | P02766 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5407163 | 0.85 | HTT (0.58) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL2372812 | 0.80 | HTT (0.60) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL6210674 | 0.80 | ALDH1A1 (0.53) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL28614014 | 0.80 | HTT (0.45) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL527567 | 0.79 | HTT (0.72) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL29441283 | 0.79 | HTT (0.72) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL6646494 | 0.79 | HTT (0.58) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL30235266 | 0.79 | HTT (0.58) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL18087973 | 0.79 | HTT (0.58) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 | |
| SCHEMBL16543584 | 0.79 | HTT (0.58) | HTTTDP1CYP19A1PTGS2SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1606268-A1 | HETEROCYCLIC KINASE INHIBITORS | Abbott Laboratories (US) | 2005-12-21 | — | — | EP | disclosed |
| WO-2004076424-A1 | HETEROCYCLIC KINASE INHIBITORS | ABBOTT LABORATORIES (US) | 2004-09-10 | — | — | WO | disclosed |