Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 4/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL12371630 | 0.81 | TACR1 (0.64) | ALDH1A1 | |
| SCHEMBL7413310 | 0.78 | ALPI (0.61) | ALDH1A1KMT2A | |
| SCHEMBL3114367 | 0.78 | ALPI (0.61) | ALDH1A1KMT2A | |
| SCHEMBL12371604 | 0.78 | CTSS (0.60) | — | |
| Hydrochloric Acid SCHEMBL27492563 | 0.76 | MMP8 (0.59) | ALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL3385081 | 0.76 | MMP8 (0.59) | ALDH1A1KMT2A | |
| SCHEMBL9364023 | 0.75 | SLC7A5 (0.61) | OPRM1OPRD1 | |
| SCHEMBL22604490 | 0.74 | CTSS (0.52) | OPRM1OPRD1 | |
| SCHEMBL10433480 | 0.73 | KMT2A (0.65) | MAPTALDH1A1HPGDKMT2AMEN1 | |
| SCHEMBL16856328 | 0.73 | PLAU (0.55) | KMT2AMEN1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009136997-A2 | INHIBITORS OF HUMAN CATHEPSIN L, CATHEPSIN B, AND CATHEPSIN S | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2009-11-12 | — | — | WO | disclosed |