Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.49 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8209631 | 0.90 | S1PR5 (0.51) | KCNH2PARP10S1PR5NPC1RAB9A | |
| SCHEMBL8208997 | 0.86 | MAOB (0.42) | KCNH2PARP10S1PR5NPC1RAB9A | |
| SCHEMBL8209442 | 0.85 | KDM1A (0.43) | MMP13KCNH2PARP10NPC1RAB9A | |
| SCHEMBL8211587 | 0.85 | S1PR1 (0.42) | S1PR5MAOBKDM1AMAOA | |
| SCHEMBL8209566 | 0.81 | POLB (0.45) | MMP13PARP10RAB9AMAOBGAA | |
| SCHEMBL8209387 | 0.78 | S1PR5 (0.42) | S1PR5NPC1RAB9AMAOBMAOA | |
| SCHEMBL8210831 | 0.77 | BTK (0.35) | MMP13KCNH2MAOBKDM1AMAOA | |
| SCHEMBL7361818 | 0.73 | KCNH2 (0.51) | MMP13KCNH2PARP10NPC1RAB9A | |
| SCHEMBL6866096 | 0.73 | MMP13 (0.44) | MMP13TP53MAOBKDM4EMAPT | |
| SCHEMBL18923951 | 0.72 | KCNH2 (0.58) | MMP13KCNH2PARP10NPC1RAB9A |
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-6114361-A | INHIBITORS OF MATRIX METALLOPROTEINASES AND REPROLYSIN; ADMINISTERING TO TREAT CONDITIONS WHICH CAN BE TREATED BY THE INHIBITION OF THESE ENZYMES | PFIZER INC. (US) | 2000-09-05 | — | — | US | claimed |