Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 7/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.54 |
| ▸ | CCR2 | P41597 | 1/20 | 0.51 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | ACLY | P53396 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | MLNR | O43193 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8524651 | 0.86 | MAPK1 (0.51) | PTGS1PTGS2CCR2PIN1ALDH1A1 | |
| SCHEMBL8099718 | 0.86 | PTGS1 (0.68) | PTGS1PTGS2CCR2PIN1MAPT | |
| SCHEMBL8588734 | 0.81 | PTGS1 (0.47) | PTGS1PTGS2CCR2ALDH1A1MAPT | |
| SCHEMBL8523996 | 0.81 | CCR2 (0.60) | PTGS1PTGS2CCR2PIN1ALDH1A1 | |
| SCHEMBL8524278 | 0.81 | PTGS1 (0.51) | PTGS1PTGS2CCR2PIN1ALDH1A1 | |
| SCHEMBL6378390 | 0.81 | PTGS1 (0.56) | PTGS1PTGS2CCR2PIN1ALDH1A1 | |
| SCHEMBL27698563 | 0.79 | PTGS1 (0.54) | PTGS1PTGS2CCR2PIN1ALDH1A1 | |
| SCHEMBL8091867 | 0.78 | ALDH1A1 (0.47) | PTGS1PTGS2ALDH1A1MAPTGAA | |
| SCHEMBL3049201 | 0.78 | CCR2 (0.57) | CCR2TSHRKDM4ECYP1A2CYP3A4 | |
| SCHEMBL4258131 | 0.78 | CCR2 (0.55) | CCR2ACLYMEN1KMT2ACYP1A2 |
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-6004948-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS; SIDE EFFECT REDUCTION | NYCOMED AUSTRIA GMBH (AT) | 1999-12-21 | — | — | US | disclosed |