Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR3C1 | P04150 | 2/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MET | P08581 | 3/20 | 0.39 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.39 |
| ▸ | WDR77 | Q9BQA1 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7216469 | 0.90 | NPC1 (0.42) | NR3C1EPHX2SMN1; SMN2HPGDPOLB | |
| SCHEMBL7217055 | 0.84 | NPC1 (0.48) | NR3C1LMNASMN1; SMN2MEN1KMT2A | |
| SCHEMBL6831069 | 0.79 | NAMPT (0.53) | ALDH1A1SMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL7216265 | 0.78 | NPC1 (0.38) | NR3C1LMNAALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL7216626 | 0.77 | APLNR (0.44) | LMNASMN1; SMN2HPGDMEN1KMT2A | |
| SCHEMBL7216812 | 0.76 | NPC1 (0.56) | LMNAALDH1A1SMN1; SMN2HPGDNPC1 | |
| SCHEMBL7367184 | 0.76 | BRD4 (0.48) | LMNATHRBSMN1; SMN2MEN1KMT2A | |
| SCHEMBL6834487 | 0.76 | GAA (0.43) | ALDH1A1SMN1; SMN2MEN1KMT2APOLB | |
| SCHEMBL7216549 | 0.75 | ROCK2 (0.37) | NR3C1LMNAPOLBNPC1TP53 | |
| SCHEMBL6834309 | 0.75 | LMNA (0.42) | LMNAALDH1A1SMN1; SMN2HPGDMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6653471-B2 | Tricyclic heteroaromatic compounds containing pyrrole ring; central nervous system disorder treatment; side effect reduction | NEUROGEN CORPORATION | 2003-11-25 | — | — | US | disclosed |