Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | PKM | P14618 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | SCN1A | P35498 | 1/20 | 0.45 |
| ▸ | HTR2B | P41595 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL992134 | 0.85 | KMT2A (0.54) | KDM4EGAAPKMCYP1A2ALDH1A1 | |
| SCHEMBL11980702 | 0.80 | ALDH1A1 (0.58) | KDM4EGAACYP1A2ALDH1A1SMN1; SMN2 | |
| SCHEMBL991095 | 0.79 | KMT2A (0.55) | KDM4ECYP1A2ALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL11985077 | 0.77 | TSHR (0.50) | CYP1A2ALDH1A1SMN1; SMN2CYP2D6TSHR | |
| SCHEMBL29233596 | 0.77 | CYP1A2 (0.88) | KDM4EGAAPKMCYP1A2ALDH1A1 | |
| SCHEMBL27859665 | 0.76 | GAA (0.57) | KDM4EGAAPKMALDH1A1HRH3 | |
| SCHEMBL19442051 | 0.76 | ATM (0.63) | KDM4EGAAPKMCYP1A2ALDH1A1 | |
| SCHEMBL991703 | 0.74 | MEN1 (0.55) | KDM4ECYP1A2ALDH1A1SMN1; SMN2HRH3 | |
| SCHEMBL28817945 | 0.74 | ALDH1A1 (0.47) | KDM4ECYP1A2ALDH1A1SMN1; SMN2TSHR | |
| SCHEMBL29233573 | 0.74 | CYP1A2 (0.86) | KDM4EGAAPKMCYP1A2ALDH1A1 |
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-9782382-B2 | TOFA analogs useful in treating dermatological disorders or conditions | DERMIRA (CANADA), INC. (US) | 2017-10-10 | — | — | US | disclosed |