Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL50658 | 0.72 | GABRA1 (0.35) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL10153919 | 0.72 | DAO (0.38) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL19187341 | 0.70 | GABRA1 (0.33) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL21720113 | 0.70 | GABRA1 (0.33) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL21737225 | 0.70 | GABRA1 (0.33) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL16806316 | 0.70 | DAO (0.37) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL3154022 | 0.67 | GABRA1 (0.52) | GABRA1GABRB2POLBALDH1A1HPGD | |
| SCHEMBL8130441 | 0.67 | KIF11 (0.33) | GABRA1GABRB2 | |
| SCHEMBL25983003 | 0.67 | GABRA1 (0.31) | GABRA1GABRB2 | |
| SCHEMBL21720505 | 0.67 | GABRA1 (0.31) | GABRA1GABRB2 |
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-20080138635-A1 | Conjugated Organic Molecules for Molecular Electronic Devices | NATIONAL UNIVERSITY OF SINGAPORE (SG) | 2008-06-12 | — | — | US | disclosed |
| WO-2006093467-A1 | CONJUGATED ORGANIC MOLECULES FOR MOLECULAR ELECTRONIC DEVICES | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2006-09-08 | — | — | WO | disclosed |