Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 2/20 | 0.40 |
| ▸ | AGBL2 | Q5U5Z8 | 2/20 | 0.40 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | GABRP | O00591 | 1/20 | 0.39 |
| ▸ | GABRD | O14764 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.39 |
| ▸ | GABRE | P78334 | 1/20 | 0.39 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.39 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL27518168 | 0.79 | AKR1B1 (0.40) | KMOAGBL2AKR1B1KDM4ECYP1A2 | |
| SCHEMBL21438176 | 0.78 | KLKB1 (0.41) | KMOKDM4EASPHKDM8P2RX7 | |
| SCHEMBL27033842 | 0.78 | GAA (0.41) | AGBL2CTSAPTGDR2LMNASMN1; SMN2 | |
| SCHEMBL29958383 | 0.78 | GAA (0.41) | AGBL2CTSAPTGDR2LMNASMN1; SMN2 | |
| SCHEMBL30546480 | 0.78 | AKR1B1 (0.52) | AKR1B1KDM4ECYP1A2MAPTCTSA | |
| SCHEMBL3611719 | 0.78 | AKR1B1 (0.52) | AKR1B1KDM4ECYP1A2MAPTCTSA | |
| SCHEMBL9455832 | 0.77 | ALDH1A1 (0.41) | KMO | |
| SCHEMBL31062319 | 0.77 | SSTR4 (0.42) | KDM4EMAPT | |
| Hydrochloric Acid SCHEMBL3638463 | 0.76 | AKR1B1 (0.50) | AKR1B1KDM4ECYP1A2MAPTCTSA | |
| SCHEMBL19584396 | 0.75 | KMO (0.32) | KMO |
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 |
|---|---|---|---|---|---|---|---|
| CN-101652363-B | Thiazolyl compounds useful as kinase inhibitors | BRISTOL MYERS SQUIBB CO | 2013-04-17 | — | — | CN | disclosed |
| CN-101652363-A | Thiazolyl compounds as kinase inhibitor | SQUIBB BRISTOL MYERS CO US | 2010-02-17 | — | — | CN | disclosed |