Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.53 |
| ▸ | RAB9A | P51151 | 3/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.50 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | APAF1 | O14727 | 1/20 | 0.48 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.47 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.47 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19586998 | 0.76 | RAB9A (0.60) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL17103166 | 0.75 | TSHR (0.58) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL11018138 | 0.73 | SMN1; SMN2 (0.59) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL4757056 | 0.73 | HDAC3 (0.62) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL6697985 | 0.72 | TSHR (0.55) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL17103078 | 0.72 | TSHR (0.67) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL4006352 | 0.72 | TSHR (0.67) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL5497702 | 0.72 | RAB9A (0.46) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL11269065 | 0.72 | TSHR (0.58) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 | |
| SCHEMBL5849741 | 0.71 | EGLN3 (0.55) | NPC1RAB9ASMN1; SMN2TSHRNPSR1 |
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-2012162635-A1 | METABOTROPIC GLUTAMATE RECEPTORS 5 MODULATORS AND METHODS OF USE THEREOF | SUNOVION PHARMACEUTICALS INC. (US) | 2012-11-29 | — | — | WO | disclosed |