Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | CA1 | P00915 | 4/20 | 0.40 |
| ▸ | CA2 | P00918 | 4/20 | 0.40 |
| ▸ | CA9 | Q16790 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.40 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.40 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.40 |
| ▸ | ELANE | P08246 | 1/20 | 0.40 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 1/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 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 | |
|---|---|---|---|---|
| SCHEMBL28257643 | 0.77 | KMT2A (0.41) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL11637354 | 0.75 | CA1 (0.45) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL10950118 | 0.75 | KMT2A (0.40) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL4902310 | 0.74 | TACR1 (0.40) | CA1CA2CA9TSHRHPGD | |
| SCHEMBL6114729 | 0.74 | KMT2A (0.61) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL9309031 | 0.74 | KMT2A (0.61) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL2155988 | 0.73 | KMT2A (0.44) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL2439083 | 0.72 | CA2 (0.61) | KMT2ACA1CA2CA9TSHR | |
| SCHEMBL11637308 | 0.71 | MEN1 (0.38) | KMT2AHTTGAACYP2C19F2 | |
| SCHEMBL354454 | 0.71 | KMT2A (0.57) | KMT2ACA1CA2CA9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-4098823-A | VASODILATION, HYPOTENSIVE AGENTS, ANTICOAGULATNS, ANTISECRETORY AGENTS, INOTROPIC AGENTS | MILES LABORATORIES, INC. (US) | 1978-07-04 | — | — | US | disclosed |