Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | RAB9A | P51151 | 8/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14436880 | 0.82 | TSHR (0.84) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL5158831 | 0.81 | TSHR (0.55) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL21758850 | 0.79 | TSHR (0.40) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL3170534 | 0.76 | TSHR (0.67) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL18768860 | 0.74 | TSHR (0.70) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL11442715 | 0.74 | RAB9A (0.53) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL29955544 | 0.73 | TSHR (0.68) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL30807225 | 0.73 | TSHR (0.62) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL10975814 | 0.73 | TSHR (0.62) | TSHRRAB9ASMN1; SMN2NPC1MEN1 | |
| SCHEMBL6536779 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0156091-B1 | BETA-OXO-ALPHA-CARBAMOYL-PYRROLEPROPIONITRILES, PROCESSES FOR THEIR PREPARATION, PHARMACEUTICAL COMPOSITIONS COMPRISING THESE COMPOUNDS AND THEIR THERAPEUTIC USE | CIBA-GEIGY AG (CH) | 1988-08-10 | — | — | EP | disclosed |
| EP-0156091-A1 | Beta-oxo-alpha-carbamoyl-pyrrolepropionitriles, processes for their preparation, pharmaceutical compositions comprising these compounds and their therapeutic use | CIBA-GEIGY AG (CH) | 1985-10-02 | — | — | EP | disclosed |