Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | MEN1 | O00255 | 3/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.65 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.65 |
| ▸ | CRHBP | P24387 | 2/20 | 0.65 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.65 |
| ▸ | ATM | Q13315 | 2/20 | 0.65 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | TNNI3 | P19429 | 1/20 | 0.50 |
| ▸ | TNNT2 | P45379 | 1/20 | 0.50 |
| ▸ | TNNC1 | P63316 | 1/20 | 0.50 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.50 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL27279706 | 0.82 | ALDH1A1 (0.65) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL5842574 | 0.79 | ALDH1A1 (0.71) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL17817838 | 0.79 | ALDH1A1 (1.00) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL1039452 | 0.79 | ALDH1A1 (1.00) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL3853529 | 0.79 | ALDH1A1 (1.00) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL3951063 | 0.78 | CA4 (0.41) | ALDH1A1MEN1KMT2AL3MBTL1MAPT | |
| SCHEMBL7821980 | 0.77 | ALDH1A1 (0.52) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| SCHEMBL27732618 | 0.77 | ALDH1A1 (0.96) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| Nitrobenzene SCHEMBL27684151 | 0.76 | ALDH1A1 (0.80) | ALDH1A1MEN1KMT2AL3MBTL1CRHBP | |
| Hydrochloric Acid SCHEMBL9721484 | 0.76 | CA4 (0.39) | ALDH1A1MEN1KMT2AL3MBTL1MAPT |
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-2247558-A1 | NOVEL IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION | Siemens Medical Solutions USA, Inc. (US) | 2010-11-10 | — | — | EP | disclosed |
| WO-2009102498-A1 | NOVEL IMAGING AGENTS FOR DETECTING NEUROLOGICAL DYSFUNCTION | SIEMENS MEDICAL SOLUTIONS USA, INC. (US) | 2009-08-20 | — | — | WO | disclosed |