Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.55 |
| ▸ | MMP13 | P45452 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | RECQL | P46063 | 2/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8935330 | 0.86 | EPHX2 (0.57) | SMN1; SMN2MAPTMAPK1LMNARECQL | |
| SCHEMBL8234001 | 0.84 | CYP3A4 (0.81) | CYP3A4SMN1; SMN2HTTMAPTCYP1A2 | |
| SCHEMBL8935268 | 0.81 | MMP13 (0.58) | CYP3A4SMN1; SMN2HTTMAPTMAPK1 | |
| SCHEMBL8935404 | 0.79 | PARP10 (0.56) | SMN1; SMN2HTTMAPTCYP1A2CYP2C19 | |
| SCHEMBL8935236 | 0.78 | MAOB (0.63) | — | |
| SCHEMBL8935322 | 0.78 | GID4 (0.71) | SMN1; SMN2HTTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL23291320 | 0.77 | CHRNA7 (0.64) | MAPK1 | |
| SCHEMBL1274303 | 0.77 | RECQL (0.71) | CYP3A4SMN1; SMN2HTTMAPTCYP1A2 | |
| SCHEMBL16610098 | 0.77 | MAPT (0.84) | CYP3A4SMN1; SMN2HTTMAPTCYP1A2 | |
| SCHEMBL1881696 | 0.77 | CYP3A4 (0.97) | CYP3A4SMN1; SMN2HTTMAPTCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5502079-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS | FARMITALIA CARLO ERBA S.R.L. (IT) | 1996-03-26 | — | — | US | disclosed |