Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MLYCD | O95822 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA5A | P35218 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | EDNRB | P24530 | 1/20 | 0.31 |
| ▸ | EDNRA | P25101 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL10710379 | 0.81 | AOC3 (0.47) | TSHRRAB9ANPC1MAPTACHE | |
| SCHEMBL10710208 | 0.80 | ALDH1A1 (0.46) | TSHRMAPTKMT2AALDH1A1MEN1 | |
| SCHEMBL17885011 | 0.77 | TSHR (0.50) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL9508337 | 0.72 | TSHR (0.55) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL18383532 | 0.72 | TSHR (0.55) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL7609864 | 0.72 | TSHR (0.55) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL9504874 | 0.72 | TSHR (0.62) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL11511029 | 0.71 | TSHR (0.60) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL4386412 | 0.71 | TSHR (0.60) | TSHRCYP19A1RAB9ANPC1MAPT | |
| SCHEMBL10906233 | 0.71 | TSHR (0.60) | TSHRCYP19A1RAB9ANPC1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0160241-B1 | PROCESS FOR PRODUCING AN ALPHA-AROMATIC GROUP SUBSTITUTED ALKANOIC ACID DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1988-11-30 | — | — | EP | disclosed |
| US-4649213-A | DIALKOXYALCOHOL, REARRANGEMENTS, BASE OR AMIDE, HALO-SULFUR COMPOUND | KYOWA HAKKO KOGYO CO. LTD. (JP) | 1987-03-10 | — | — | US | disclosed |
| EP-0160241-A1 | Process for producing an alpha-aromatic group substituted alkanoic acid derivative | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1985-11-06 | — | — | EP | disclosed |