Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | XDH | P47989 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | ANPEP | P15144 | 1/20 | 0.38 |
| ▸ | LTA4H | P09960 | 2/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL4511545 | 0.92 | KMT2A (0.45) | HPGDKMT2AADRB2XDHSLC6A4 | |
| SCHEMBL4515035 | 0.72 | FKBP1A (0.44) | HPGDKMT2ACYP3A4KDM4EALDH1A1 | |
| SCHEMBL30813921 | 0.69 | TSHR (0.43) | KMT2AKDM4EALDH1A1FKBP1ALMNA | |
| SCHEMBL19584148 | 0.69 | TSHR (0.43) | KMT2AKDM4EALDH1A1FKBP1ALMNA | |
| SCHEMBL30813083 | 0.67 | MMP2 (0.35) | KMT2ACYP3A4ALDH1A1FKBP1AMMP2 | |
| SCHEMBL19583645 | 0.67 | MMP2 (0.35) | KMT2ACYP3A4ALDH1A1FKBP1AMMP2 | |
| SCHEMBL19583679 | 0.67 | MMP2 (0.35) | KMT2ACYP3A4ALDH1A1FKBP1AMMP2 | |
| SCHEMBL30813702 | 0.65 | PREP (0.54) | KMT2AALDH1A1 | |
| SCHEMBL22452838 | 0.65 | CAPN1 (0.58) | KMT2AALDH1A1FKBP1A | |
| SCHEMBL28681218 | 0.65 | CAPN1 (0.58) | KMT2AALDH1A1FKBP1A |
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 |
|---|---|---|---|---|---|---|---|
| US-7618983-B2 | Bicyclic triazole α4 integrin inhibitors | JANSSEN PHARMACEUTICA, N.V. (BE) | 2009-11-17 | — | — | US | disclosed |
| US-7618983-B2 | Bicyclic triazole α4 integrin inhibitors | JANSSEN PHARMACEUTICA, N.V. (BE) | 2009-11-17 | — | — | US | disclosed |