Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | GABRP | O00591 | 1/20 | 0.40 |
| ▸ | GABRD | O14764 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.40 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.40 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.40 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.40 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.40 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.40 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.40 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.40 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.40 |
| ▸ | GABRE | P78334 | 1/20 | 0.40 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.40 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.40 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.40 |
| ▸ | GABRQ | Q9UN88 | 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 | |
|---|---|---|---|---|
| SCHEMBL7394534 | 0.89 | CYP1A2 (0.47) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL7997018 | 0.86 | MMP3 (0.44) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL7483747 | 0.85 | CYP3A4 (0.46) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL7394692 | 0.81 | TDP1 (0.44) | CYP3A4ALDH1A1TSHRHPGDKMT2A | |
| SCHEMBL8100905 | 0.79 | CYP3A4 (0.61) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL7071011 | 0.79 | CYP3A4 (0.53) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL7594254 | 0.78 | CYP3A4 (0.34) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL28662473 | 0.77 | CYP3A4 (0.57) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL8100908 | 0.76 | CYP3A4 (0.54) | CYP3A4ALDH1A1HSD17B10TSHRGABRP | |
| SCHEMBL3643355 | 0.76 | MTNR1A (0.41) | MMP3MEN1KMT2AKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6288261-B1 | DRUGS FOR INHIBITION OF ENZYMES | ABBOTT LABORATORIES | 2001-09-11 | — | — | US | disclosed |
| WO-2000037433-A1 | INHIBITORS OF MATRIX METALLOPROTEINASES | ABBOTT LABORATORIES (US) | 2000-06-29 | — | — | WO | disclosed |