Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.32 |
| ▸ | HTT | P42858 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | XBP1 | P17861 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.32 |
| ▸ | MITF | O75030 | 1/20 | 0.31 |
| ▸ | ALPL | P05186 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | APEX1 | P27695 | 1/20 | 0.31 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.31 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL628550 | 0.82 | ALDH1A1 (0.41) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL2115831 | 0.82 | TSHR (0.36) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL9871854 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL1123974 | 0.78 | MAPT (0.39) | ALDH1A1TSHRMAPTSMN1; SMN2NPC1 | |
| SCHEMBL14135692 | 0.78 | TSHR (0.38) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL12647914 | 0.78 | TSHR (0.38) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL2042482 | 0.74 | POLB (0.39) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL24238615 | 0.74 | ALDH1A1 (0.44) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL1426637 | 0.74 | ALDH1A1 (0.37) | ALDH1A1TSHRMAPTHTTSMN1; SMN2 | |
| SCHEMBL18227006 | 0.73 | TSHR (0.38) | ALDH1A1TSHRMAPTPOLBGRIN2D |
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-2017069661-A1 | PYRIMIDYL-DI(DIAZASPIRO-ALKANES) WITH ANTIVIRAL ACTIVITY | Limited Liability Company “Nearmedic Plus” (RU) | 2017-04-27 | — | — | WO | disclosed |