Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA3 | P07451 | 3/20 | 0.40 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | CA7 | P43166 | 3/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA5A | P35218 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3310966 | 0.87 | CA12 (0.41) | CA2CA1CA3CA6CA7 | |
| SCHEMBL24694102 | 0.80 | DRD2 (0.53) | ALOX15TSHRLMNAADRA2ADRD2 | |
| SCHEMBL3057899 | 0.71 | ALDH1A1 (0.49) | ALOX15ALDH1A1HPGDHSD17B10GAA | |
| SCHEMBL25057456 | 0.71 | TSHR (0.41) | TSHRLMNAMAPK1ALDH1A1HPGD | |
| SCHEMBL9811329 | 0.70 | CA2 (0.50) | CA2CA1CA3CA6CA7 | |
| SCHEMBL3313702 | 0.70 | ADRA2A (0.53) | CA2CA1CA3CA6CA7 | |
| SCHEMBL29510768 | 0.70 | ADRA2A (0.53) | CA2CA1CA3CA6CA7 | |
| SCHEMBL31376269 | 0.69 | GAA (0.57) | CA2ALOX15TSHRLMNAADRA2A | |
| SCHEMBL12070949 | 0.69 | GAA (0.57) | CA2ALOX15TSHRLMNAADRA2A | |
| SCHEMBL28339029 | 0.69 | DRD2 (0.52) | ALOX15TSHRLMNAADRA2ADRD2 |
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-1998039295-A1 | (R)N-(1-CYCLOPROPYLMETHYLPYRROLIDIN-2-YLMETHYL)BENZAMIDE AND ITS USE AS AN ANTIDIARRHOEAL | JOUVEINAL (FR) | 1998-09-11 | — | — | WO | disclosed |