Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.43 |
| ▸ | PPP1CA | P62136 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 7/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | METAP1 | P53582 | 2/20 | 0.36 |
| ▸ | METAP2 | P50579 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | F12 | P00748 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL15626284 | 0.83 | FFAR1 (0.38) | FFAR1ALDH1A1ATMMETAP1METAP2 | |
| SCHEMBL16989342 | 0.81 | FFAR1 (0.36) | NPC1L3MBTL1SMN1; SMN2FFAR1RAB9A | |
| SCHEMBL15626286 | 0.81 | FFAR1 (0.36) | NPC1L3MBTL1SMN1; SMN2FFAR1RAB9A | |
| SCHEMBL21170664 | 0.77 | HRH3 (0.41) | MAPTCYP1A2CYP2D6CYP19A1CYP2C9 | |
| SCHEMBL4016532 | 0.72 | PAICS (0.37) | CDK2 | |
| SCHEMBL4018558 | 0.72 | LIMK1 (0.37) | MAPT | |
| SCHEMBL4016367 | 0.71 | ESR1 (0.35) | CDK2MAPTKDR | |
| SCHEMBL4022147 | 0.71 | METAP1 (0.51) | NPC1HTTL3MBTL1PPP1CASMN1; SMN2 | |
| SCHEMBL4018429 | 0.70 | ESR1 (0.35) | KDR | |
| SCHEMBL16989331 | 0.70 | LIMK1 (0.36) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2903436-B1 | HETEROCYCLIC COMPOUNDS AND THEIR USE FOR THE TREATMENT OF NEURODEGENERATIVE TAUOPATHIES | UNIV PENNSYLVANIA (US) | 2019-07-17 | — | — | EP | disclosed |