Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 2/20 | 0.42 |
| ▸ | CPB1 | P15086 | 1/20 | 0.42 |
| ▸ | CPA3 | P15088 | 1/20 | 0.42 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.41 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10696233 | 0.84 | TSHR (0.53) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL19946640 | 0.83 | CRHBP (0.44) | CYP1A2TSHRHSD17B10KMT2AMEN1 | |
| SCHEMBL10525325 | 0.81 | CYP1A2 (0.57) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL20563859 | 0.80 | CYP1A2 (0.55) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6387359 | 0.79 | POLB (0.55) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL31483446 | 0.78 | CYP1A2 (0.50) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL2456546 | 0.78 | MEN1 (0.58) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL25816145 | 0.78 | CYP1A2 (0.57) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL372276 | 0.78 | CYP1A2 (0.57) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL7300866 | 0.78 | TSHR (0.57) | CYP1A2TSHRKDM4EALDH1A1HSD17B10 |
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-0253501-A2 | N-disubstituted cycloalkylmethyl amines useful as fungicides | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-01-20 | — | — | EP | disclosed |