Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 7/20 | 0.58 |
| ▸ | RAB9A | P51151 | 7/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | CRHBP | P24387 | 1/20 | 0.47 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL21997981 | 0.80 | NPC1 (0.49) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL12200275 | 0.79 | RAB9A (0.85) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL8827244 | 0.76 | HTT (0.72) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL8970994 | 0.76 | NPC1 (0.60) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL18517842 | 0.75 | RAB9A (0.76) | NPC1RAB9ASMN1; SMN2MAPTLMNA | |
| SCHEMBL7183238 | 0.74 | RAB9A (0.67) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL20413311 | 0.74 | NPC1 (0.67) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL822378 | 0.74 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL172125 | 0.74 | ALDH1A1 (0.67) | NPC1RAB9ASMN1; SMN2MAPTPOLB | |
| SCHEMBL12310125 | 0.74 | RAB9A (1.00) | NPC1RAB9ASMN1; SMN2MAPTPOLB |
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-20200148827-A1 | TWO-DIMENSIONAL POLYMERS COMPRISED OF A COMBINATION OF STIFF AND COMPLIANT MOLECULAR UNITS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY | 2020-05-14 | — | — | US | disclosed |