Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | BCHE | P06276 | 1/20 | 0.31 |
| ▸ | CES1 | P23141 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | BLVRB | P30043 | 1/20 | 0.30 |
| ▸ | ORAI1 | Q96D31 | 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 | |
|---|---|---|---|---|
| SCHEMBL135288 | 0.82 | AKR1C1 (0.35) | CA1CA2HDAC4POLBHCAR2 | |
| SCHEMBL1832298 | 0.80 | PTGDR2 (0.38) | CA1CA2POLBHCAR2 | |
| Isopropylamine SCHEMBL28970090 | 0.74 | ALDH1A1 (0.34) | HCAR2KDM4E | |
| SCHEMBL31621764 | 0.71 | KAT6A (0.42) | CA1CA2KDM4E | |
| SCHEMBL29498824 | 0.70 | LDHA (0.36) | CA1CA2HDAC4HDAC9NPC1 | |
| SCHEMBL28574647 | 0.70 | POLB (0.35) | CA1CA2HDAC4POLBHDAC9 | |
| SCHEMBL12971595 | 0.69 | HDAC4 (0.31) | HDAC4 | |
| SCHEMBL31501097 | 0.67 | MEN1 (0.37) | POLBHCAR2HDAC9KDM4ENPC1 | |
| SCHEMBL31501098 | 0.67 | MEN1 (0.37) | POLBHCAR2HDAC9KDM4ENPC1 | |
| SCHEMBL7167294 | 0.67 | MAPT (0.45) | KDM4ERAB9A |
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-103429578-A | Herbicide safener composition | BAYER IP GMBH | 2013-12-04 | — | — | CN | disclosed |
| CN-103270034-A | NOVEL SUBSTITUTED PICOLINIC ACIDS, SALTS AND ACID DERIVATIVES THEREOF, AND USE THEREOF AS HERBICIDES | BAYER IP GMBH | 2013-08-28 | — | — | CN | disclosed |