Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL14857329 | 0.84 | POLB (0.51) | KDM4ESMN1; SMN2THRBALDH1A1POLB | |
| SCHEMBL14857112 | 0.79 | L3MBTL1 (0.45) | ALDH1A1KMT2A | |
| SCHEMBL14857312 | 0.78 | KMT2A (0.40) | THRBALDH1A1TSHRKMT2APOLB | |
| SCHEMBL992344 | 0.75 | KMT2A (0.47) | KDM4ESMN1; SMN2THRBALDH1A1TSHR | |
| SCHEMBL14857296 | 0.72 | PPARG (0.39) | ALDH1A1TSHRTP53MAPT | |
| SCHEMBL14857330 | 0.71 | THRB (0.48) | KDM4ESMN1; SMN2THRBALDH1A1TSHR | |
| SCHEMBL14857326 | 0.71 | THRB (0.48) | KDM4ESMN1; SMN2THRBALDH1A1KMT2A | |
| SCHEMBL14857331 | 0.70 | TSHR (0.36) | ALDH1A1TSHRTP53NPSR1 | |
| SCHEMBL14857301 | 0.70 | TSHR (0.36) | ALDH1A1TSHRCYP2D6 | |
| SCHEMBL14857335 | 0.69 | ALDH1A1 (0.36) | SMN1; SMN2THRBALDH1A1KMT2APOLB |
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-2451796-B1 | TOFA ANALOGS USEFUL IN TREATING DERMATOLOGICAL DISORDERS OR CONDITIONS | DERMIRA CANADA INC (US) | 2013-04-17 | — | — | EP | claimed |