Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CASP1 | P29466 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.42 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL19841877 | 0.83 | MAPT (0.61) | TDP1MAPTALDH1A1CASP1CYP3A4 | |
| SCHEMBL11063883 | 0.82 | PRSS1 (0.61) | MAPTALDH1A1CYP3A4SMN1; SMN2HTT | |
| SCHEMBL29757192 | 0.82 | PRSS1 (0.61) | MAPTALDH1A1CYP3A4SMN1; SMN2HTT | |
| SCHEMBL284729 | 0.78 | TDP1 (0.73) | TDP1MAPTALDH1A1CASP1CYP3A4 | |
| SCHEMBL13636369 | 0.78 | TDP1 (0.61) | TDP1MAPTALDH1A1CASP1CYP3A4 | |
| SCHEMBL12851321 | 0.78 | MAPT (0.55) | TDP1MAPTALDH1A1CASP1CYP3A4 | |
| SCHEMBL8262228 | 0.77 | MTOR (0.42) | TDP1MAPTALDH1A1CYP3A4SMN1; SMN2 | |
| SCHEMBL1459704 | 0.77 | HPGD (0.47) | TDP1ALDH1A1SMN1; SMN2HTTPRSS1 | |
| SCHEMBL13783388 | 0.76 | MAPT (0.76) | TDP1MAPTALDH1A1CASP1CYP3A4 | |
| SCHEMBL14741800 | 0.75 | MAPT (0.57) | TDP1MAPTALDH1A1CASP1CYP3A4 |
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-1409463-B1 | N-HETEROCYCLIC INHIBITORS OF TNF-ALPHA EXPRESSION | BRISTOL MYERS SQUIBB CO (US) | 2010-02-24 | — | — | EP | disclosed |
| US-7479495-B2 | N-heterocyclic inhibitors of TNF-α expression | PHARMACOPEIA, INC. (US) | 2009-01-20 | — | — | US | disclosed |
| US-7479495-B2 | N-heterocyclic inhibitors of TNF-α expression | PHARMACOPEIA, INC. (US) | 2009-01-20 | — | — | US | disclosed |