Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.57 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.55 |
| ▸ | PTGER4 | P35408 | 2/20 | 0.55 |
| ▸ | PTGER3 | P43115 | 2/20 | 0.55 |
| ▸ | PTGER2 | P43116 | 2/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.54 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.50 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.50 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.49 |
| ▸ | MMP1 | P03956 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL538512 | 0.98 | KMT2A (0.60) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| SCHEMBL28594606 | 0.96 | KMT2A (0.58) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| Ammonia Solution, Strong SCHEMBL27926479 | 0.96 | KMT2A (0.58) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| SCHEMBL27701716 | 0.96 | KMT2A (0.58) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| Hydrochloric Acid SCHEMBL11895689 | 0.96 | KMT2A (0.58) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| Ethane SCHEMBL28588588 | 0.94 | PTGS1 (0.57) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| SCHEMBL5961842 | 0.94 | PTGS1 (0.59) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| SCHEMBL8645744 | 0.92 | PTGS1 (0.55) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| SCHEMBL2925422 | 0.90 | AKR1B1 (0.55) | KMT2AAKR1B1PTGER1PTGER4PTGER3 | |
| Biphenyl SCHEMBL11146899 | 0.88 | AKR1B1 (0.57) | KMT2AAKR1B1PTGER1PTGER4PTGER3 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115557907-A | 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors | 拜耳股份有限公司 | 2023-01-03 | — | — | CN | disclosed |
| CN-110023302-B | 2,4, 5-trisubstituted 1,2, 4-triazolones as DHODH inhibitors | 拜耳股份有限公司 | 2022-07-26 | — | — | CN | disclosed |
| CN-110248937-B | 4, 5-Cyclic 1,2, 4-triazolones | 拜耳股份有限公司 | 2022-03-29 | — | — | CN | disclosed |