Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 1/20 | 0.57 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | PTPRC | P08575 | 2/20 | 0.38 |
| ▸ | CTSS | P25774 | 4/20 | 0.37 |
| ▸ | CTSK | P43235 | 4/20 | 0.37 |
| ▸ | ACE | P12821 | 2/20 | 0.37 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | CPA1 | P15085 | 1/20 | 0.37 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.36 |
| ▸ | CTSB | P07858 | 1/20 | 0.36 |
| ▸ | MMP1 | P03956 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12017898 | 0.84 | CYP2D6 (0.41) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL29037226 | 0.82 | MEN1 (0.46) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL38660142 | 0.82 | MAPT (0.63) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL20817281 | 0.82 | MAPT (0.63) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL6468610 | 0.82 | MAPT (0.63) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL12884403 | 0.81 | CYP2D6 (0.42) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL27072723 | 0.81 | CYP2D6 (0.39) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL2113714 | 0.81 | CYP2D6 (0.39) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL18924130 | 0.81 | CYP2D6 (0.39) | ALDH1A1LMNAMAPTPTGS2TDP1 | |
| SCHEMBL18850615 | 0.78 | LMNA (0.59) | ALDH1A1LMNAMAPTPTGS2TDP1 |
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-9988340-B2 | Compositions and methods for the treatment of multiple sclerosis | CELLIX BIO PRIVATE LIMITED (IN) | 2018-06-05 | — | — | US | disclosed |
| US-9932294-B2 | Compositions and methods for the treatment of multiple sclerosis | CELLIX BIO PRIVATE LIMITED (IN) | 2018-04-03 | — | — | US | disclosed |
| US-9580383-B2 | Compositions and methods for the treatment of multiple sclerosis | CELLIX BIO PRIVATE LIMITED (IN) | 2017-02-28 | — | — | US | disclosed |