Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.32 |
| ▸ | GABRA5 | P31644 | 2/20 | 0.32 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.32 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.32 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.32 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.32 |
| ▸ | GABRE | P78334 | 1/20 | 0.32 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.32 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.32 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16704593 | 0.92 | NPC1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL16704583 | 0.90 | NPC1 (0.37) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL12685771 | 0.89 | ENPP1 (0.31) | MAPTALDH1A1MEN1KMT2AHPGD | |
| SCHEMBL16704581 | 0.89 | NPC1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL17536911 | 0.86 | NPC1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL16704592 | 0.85 | GABRA1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL16704596 | 0.85 | GABRA1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL16704591 | 0.84 | MAOA (0.39) | NPC1RAB9ATSHRSMN1; SMN2TP53 | |
| SCHEMBL12685773 | 0.83 | HTT (0.33) | SMN1; SMN2MAPTHTTHPGD | |
| SCHEMBL16704586 | 0.83 | GABRA1 (0.38) | NPC1RAB9ATSHRSMN1; SMN2TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012107163-A1 | SUBSTITUTED DIBENZONAPHTHACENE | MERCK PATENT GMBH (DE) | 2012-08-16 | — | — | WO | disclosed |