Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.38 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | MMP14 | P50281 | 1/20 | 0.36 |
| ▸ | FABP1 | P07148 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7396002 | 0.76 | CKS1B (0.49) | ALDH1A1HTTMEN1KMT2ATDP1 | |
| SCHEMBL7394535 | 0.74 | CKS1B (0.49) | ALDH1A1HTTMEN1KMT2AGAA | |
| SCHEMBL7419866 | 0.72 | RAB9A (0.44) | ALDH1A1HTR2CHTTMEN1KMT2A | |
| SCHEMBL6782097 | 0.69 | HTR2C (0.50) | ALDH1A1HTR2CHTTLMNASMN1; SMN2 | |
| SCHEMBL7379409 | 0.67 | SMN1; SMN2 (0.42) | ALDH1A1HTTMEN1KMT2AFFAR1 | |
| SCHEMBL7445307 | 0.67 | TGFBR1 (0.40) | ALDH1A1HPGDMAPTLMNASMN1; SMN2 | |
| SCHEMBL7393202 | 0.65 | SMN1; SMN2 (0.42) | ALDH1A1HTTMEN1KMT2ATDP1 | |
| SCHEMBL23882572 | 0.64 | ROCK2 (0.61) | ALDH1A1HTTMEN1KMT2AGAA | |
| SCHEMBL30947514 | 0.63 | PDE9A (0.56) | — | |
| SCHEMBL15550259 | 0.63 | PDE9A (0.56) | — |
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-0966454-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | Boehringer Ingelheim Pharma KG (DE) | 1999-12-29 | — | — | EP | disclosed |
| WO-1998037075-A1 | DISUBSTITUTED BICYCLIC HETEROCYCLES, THEIR PRODUCTION AND USE AS MEDICAMENTS | BOEHRINGER INGELHEIM PHARMA KG (DE) | 1998-08-27 | — | — | WO | disclosed |