Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.50 |
| ▸ | RAB9A | P51151 | 5/20 | 0.50 |
| ▸ | NPC1 | O15118 | 4/20 | 0.50 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.48 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.48 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | CA12 | O43570 | 2/20 | 0.45 |
| ▸ | CA1 | P00915 | 2/20 | 0.45 |
| ▸ | CA2 | P00918 | 2/20 | 0.45 |
| ▸ | CA3 | P07451 | 2/20 | 0.45 |
| ▸ | CA4 | P22748 | 2/20 | 0.45 |
| ▸ | CA6 | P23280 | 2/20 | 0.45 |
| ▸ | CA5A | P35218 | 2/20 | 0.45 |
| ▸ | CA7 | P43166 | 2/20 | 0.45 |
| ▸ | CA9 | Q16790 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8779377 | 0.90 | ALDH1A1 (0.57) | SMN1; SMN2RAB9ANPC1DYRK1AKMT2A | |
| SCHEMBL8246439 | 0.89 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1CSNK2A2CSNK2A1 | |
| 4-Nitrotoluene SCHEMBL8779382 | 0.88 | CSNK2A2 (0.64) | SMN1; SMN2RAB9ANPC1DYRK1ACSNK2A2 | |
| SCHEMBL28799002 | 0.84 | SMN1; SMN2 (0.72) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL8779455 | 0.79 | SMN1; SMN2 (0.53) | SMN1; SMN2RAB9ANPC1TSHRKMT2A | |
| SCHEMBL6992440 | 0.76 | TP53 (0.40) | SMN1; SMN2RAB9ANPC1TDP1POLB | |
| SCHEMBL629408 | 0.75 | CA1 (0.62) | SMN1; SMN2RAB9ANPC1CSNK2A2CSNK2A1 | |
| SCHEMBL8032721 | 0.74 | SMN1; SMN2 (0.55) | SMN1; SMN2RAB9ANPC1POLBKMT2A | |
| SCHEMBL9796243 | 0.73 | CA1 (0.62) | SMN1; SMN2TDP1POLBKMT2AMEN1 | |
| SCHEMBL2629359 | 0.72 | SMN1; SMN2 (0.65) | SMN1; SMN2RAB9ANPC1TDP1POLB |
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 |
|---|---|---|---|---|---|---|---|
| EP-0579129-B1 | Thiadiazole derivatives for the treatment of depressive states | CT LAB FARM SRL (IT) | 1997-03-05 | — | — | EP | claimed |