Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL14966454 | 0.99 | TSHR (0.52) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL12120425 | 0.99 | CYP1A2 (0.54) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL14970722 | 0.89 | SMN1; SMN2 (0.55) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL14966443 | 0.88 | SMN1; SMN2 (0.53) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL1307575 | 0.84 | TSHR (0.53) | TSHRCYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL14970728 | 0.82 | LTA4H (0.53) | TSHRSMN1; SMN2KDM4EMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL14966567 | 0.81 | LTA4H (0.52) | TSHRSMN1; SMN2KDM4ELTA4H | |
| SCHEMBL14970479 | 0.80 | SMN1; SMN2 (0.74) | TSHRCYP1A2CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL14970678 | 0.80 | MEN1 (0.73) | TSHRCYP1A2CYP2D6CYP2C19SMN1; SMN2 | |
| SCHEMBL14970672 | 0.80 | MEN1 (0.73) | TSHRCYP1A2CYP2D6CYP2C19SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013074965-A1 | AMINOALKYL PHENOL ETHER INHIBITORS OF INFLUENZA A VIRUS | MICROBIOTIX, INC. (US) | 2013-05-23 | — | — | WO | disclosed |