Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | PPP1CA | P62136 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | CFD | P00746 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1554542 | 0.91 | ALDH1A1 (0.51) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL9893133 | 0.85 | ALDH1A1 (0.59) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL4228227 | 0.83 | ALDH1A1 (0.58) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL14296414 | 0.80 | ALDH1A1 (0.63) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL17728269 | 0.80 | ALDH1A1 (0.54) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL2024842 | 0.79 | ALDH1A1 (0.61) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL1555269 | 0.79 | ALDH1A1 (0.61) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL1555271 | 0.79 | ALDH1A1 (0.61) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL1555270 | 0.79 | ALDH1A1 (0.61) | ALDH1A1HTTTDP1LMNAPPP1CA | |
| SCHEMBL7963467 | 0.77 | ALDH1A1 (0.59) | ALDH1A1HTTTDP1LMNAPPP1CA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011000945-A9 | AMINOALKAMIDES FOR USE IN THE TREATMENT OF INFLAMMATORY, DEGENERATIVE OR DEMYELINATING DISEASES OF THE CNS | NENSIUS RESEARCH A/S (DK) | 2011-04-07 | — | — | WO | disclosed |
| WO-2011000945-A2 | AMINOALKAMIDES FOR USE IN THE TREATMENT OF INFLAMMATORY, DEGENERATIVE OR DEMYELINATING DISEASES OF THE CNS | NENSIUS RESEARCH A/S (DK) | 2011-01-06 | — | — | WO | disclosed |