Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.33 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | GBA1 | P04062 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.31 |
| ▸ | HRH2 | P25021 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11272321 | 0.80 | ALDH1A1 (0.34) | MAPTNPC1RAB9AALDH1A1TSHR | |
| SCHEMBL11168503 | 0.80 | SIGMAR1 (0.34) | HDAC3HDAC1HDAC2AAK1TSHR | |
| SCHEMBL11264437 | 0.80 | SIGMAR1 (0.33) | HDAC3HDAC1HDAC2AAK1LMNA | |
| SCHEMBL11265198 | 0.78 | EPHX1 (0.35) | — | |
| SCHEMBL11160453 | 0.78 | EPHX1 (0.35) | — | |
| SCHEMBL11155609 | 0.77 | EPHX1 (0.34) | — | |
| SCHEMBL11172342 | 0.76 | HDAC6 (0.39) | NPC1RAB9AHDAC3HDAC1HDAC2 | |
| SCHEMBL11272331 | 0.74 | CYP2D6 (0.42) | ALDH1A1TSHRHSD17B10MAPK1GAA | |
| SCHEMBL11149398 | 0.74 | HDAC6 (0.37) | HDAC3HDAC1HDAC2AAK1TSHR | |
| SCHEMBL11155491 | 0.73 | HDAC6 (0.36) | MAPTNPC1RAB9AHDAC3HDAC1 |
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-4362738-A | ANTIINFLAMMATORIES | DR. KARL THOMAE GMBH (DE) | 1982-12-07 | — | — | US | disclosed |