Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | PTPRC | P08575 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.37 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28936763 | 1.00 | KMT2A (0.42) | KMT2ASMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL28712832 | 0.83 | KMT2A (0.48) | KMT2ASMN1; SMN2GAARAB9ACA1 | |
| SCHEMBL28712834 | 0.83 | KMT2A (0.48) | KMT2ASMN1; SMN2GAARAB9ACA1 | |
| SCHEMBL28700397 | 0.80 | KMT2A (0.41) | KMT2ASMN1; SMN2LMNAMEN1TDP1 | |
| SCHEMBL28700396 | 0.80 | KMT2A (0.41) | KMT2ASMN1; SMN2LMNAMEN1TDP1 | |
| SCHEMBL3301559 | 0.70 | ALDH1A1 (0.50) | SMN1; SMN2NPC1RAB9APTPRCPTPN1 | |
| SCHEMBL5099185 | 0.67 | MME (0.54) | PTPRCPTPN1 | |
| SCHEMBL5099195 | 0.67 | MME (0.54) | PTPRCPTPN1 | |
| SCHEMBL2905447 | 0.66 | KDM4E (0.46) | KMT2ASMN1; SMN2GAANPC1RAB9A | |
| SCHEMBL2619549 | 0.66 | MDM4 (0.65) | KMT2ALMNACYP2C9CYP2C19MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114206832-A | Urea compounds antagonizing LPA1 receptor | 大正制药株式会社 | 2022-03-18 | — | — | CN | disclosed |