Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.48 |
| ▸ | CASP3 | P42574 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | GRIN2B | Q13224 | 3/20 | 0.46 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8594128 | 0.91 | SMN1; SMN2 (0.55) | HTTRAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL8554226 | 0.83 | SMN1; SMN2 (0.47) | TSHRALDH1A1HTTGAAHSD17B10 | |
| SCHEMBL3594917 | 0.82 | SMN1; SMN2 (0.51) | TSHRALDH1A1HTTGAAHSD17B10 | |
| SCHEMBL8626081 | 0.82 | SMN1; SMN2 (0.51) | TSHRALDH1A1HTTGAAHSD17B10 | |
| SCHEMBL14507429 | 0.79 | SMN1; SMN2 (0.51) | TSHRALDH1A1HTTGAAHSD17B10 | |
| SCHEMBL2710739 | 0.78 | KMT2A (0.60) | TSHRALDH1A1HTTGAAHSD17B10 | |
| SCHEMBL20135566 | 0.78 | SMN1; SMN2 (0.51) | HTTRAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL8552781 | 0.78 | LMNA (0.47) | ALDH1A1HTTGAARAB9ANPC1 | |
| SCHEMBL20135380 | 0.77 | AADAT (0.58) | HTTRAB9ANPC1SMN1; SMN2CYP2C19 | |
| SCHEMBL17766765 | 0.76 | ALDH1A1 (0.57) | TSHRALDH1A1HTTGAAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-5817677-A | ANTITHROMBOSIS AGENTS | DR. KARL THOMAE GMBH (DE) | 1998-10-06 | — | — | US | disclosed |
| EP-0858457-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | Dr. Karl Thomae GmbH (DE) | 1998-08-19 | — | — | EP | disclosed |
| WO-1997015567-A1 | 5-MEMBERED HETEROCYCLES, PHARMACEUTICAL AGENTS CONTAINING SAID COMPOUNDS AND THE USE THEREOF AND METHODS OF PRODUCING THEM | DR. KARL THOMAE GMBH (DE) | 1997-05-01 | — | — | WO | disclosed |