Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | PDE2A | O00408 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | PDE5A | O76074 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KCNN3 | Q9UGI6 | 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 | |
|---|---|---|---|---|
| SCHEMBL3788149 | 0.82 | CD38 (0.46) | TSHRPDE2ACYP3A4CYP2C19HSD17B10 | |
| SCHEMBL20511207 | 0.81 | DCTPP1 (0.52) | TSHRCHRM2KCNN3NFKB1MAPK1 | |
| SCHEMBL14869738 | 0.81 | HRH4 (0.53) | TP53HDAC3HDAC1HDAC2HDAC6 | |
| SCHEMBL20511040 | 0.79 | HDAC3 (0.49) | HDAC3HDAC1HDAC2HDAC6PDE5A | |
| SCHEMBL5477205 | 0.78 | NPC1 (0.49) | ALDH1A1POLBNPC1RAB9ACYP3A4 | |
| SCHEMBL6739809 | 0.78 | GAA (0.58) | TSHRTP53HDAC3HDAC1HDAC2 | |
| SCHEMBL1562297 | 0.76 | APP (0.59) | ALDH1A1PDE5ANFKB1GAAMAPT | |
| SCHEMBL29558335 | 0.76 | PDE5A (0.61) | PDE2ATP53ALDH1A1POLBPDE5A | |
| SCHEMBL6690806 | 0.75 | RAB9A (0.67) | TP53NPC1RAB9ACHRM2PNMT | |
| SCHEMBL29168139 | 0.75 | P2RX7 (0.46) | TP53ALDH1A1POLBCYP3A4CYP2C19 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020146779-A1 | mTORC1 INHIBITORS FOR ACTIVATING AUTOPHAGY | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-07-16 | — | — | WO | disclosed |
| WO-2018175958-A1 | THIOREDOXIN MODULATORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2018-09-27 | — | — | WO | disclosed |