Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 4/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7530892 | 0.79 | ALDH1A1 (0.41) | SIRT1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL6400844 | 0.78 | ALDH1A1 (0.38) | SIRT1ALDH1A1KDM4ETSHRTDP1 | |
| SCHEMBL7537292 | 0.77 | TP53 (0.51) | SIRT1TP53ALDH1A1KDM4ETDP1 | |
| SCHEMBL5083219 | 0.65 | AVPR1A (0.40) | SIRT1TP53ALDH1A1KDM4ESMN1; SMN2 | |
| SCHEMBL9717769 | 0.65 | ALDH1A1 (0.58) | ALDH1A1KDM4ETSHRTDP1FGFR1 | |
| SCHEMBL6401662 | 0.63 | ALDH1A1 (0.43) | ALDH1A1KDM4ETSHRTDP1LMNA | |
| SCHEMBL6224414 | 0.62 | ALDH1A1 (0.58) | ALDH1A1KDM4ETSHRTDP1FGFR1 | |
| SCHEMBL918824 | 0.62 | CYP1A1 (0.61) | ALDH1A1KDM4ETSHRTDP1FGFR1 | |
| SCHEMBL918825 | 0.62 | CYP1A1 (0.61) | ALDH1A1KDM4ETSHRTDP1FGFR1 | |
| SCHEMBL19662549 | 0.62 | GPR35 (0.41) | TP53ALDH1A1KDM4ETDP1SMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1032571-B1 | PIPERIDINYLAMINOMETHYL TRIFLUOROMETHYL CYCLIC ETHER COMPOUNDS AS SUBSTANCE P ANTAGONISTS | PFIZER (US) | 2002-06-12 | — | — | EP | claimed |