Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.36 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.36 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8804890 | 0.88 | ALDH1A1 (0.50) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL8804894 | 0.88 | ALDH1A1 (0.50) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL27166846 | 0.85 | ALDH1A1 (0.44) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL7877336 | 0.82 | CYP1A2 (0.55) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL3414946 | 0.82 | ALDH1A1 (0.70) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL16811748 | 0.81 | ALDH1A1 (0.56) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL8805565 | 0.81 | ALDH1A1 (0.56) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL7877446 | 0.81 | ALDH1A1 (0.56) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL8330910 | 0.80 | ALDH1A1 (0.55) | ALDH1A1CYP1A2NPSR1TSHRHTT | |
| SCHEMBL17094771 | 0.77 | ALDH1A1 (0.42) | ALDH1A1CYP1A2NPSR1TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-6310083-B1 | DERIVATIVES OF O-NITROMANDELYOXYCARBONYL WHICH ARE CAPABLE OF RELEASING AMINO ACIDS (OR DERIVATIVES THEREOF) UPON IRRADIATION WITH ULTRAVIOLET LIGHT; PRODUCING AMINO ACIDS (OR DERIVATIVES THEREOF) FOR USE IN NEUROPHYSIOLOGY STUDIES | UNIVERSITY OF MARYLAND BOITECHNOLOGY INSTITUTE | 2001-10-30 | — | — | US | disclosed |