Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.40 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.40 |
| ▸ | CTSK | P43235 | 3/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | CTSL | P07711 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6585584 | 1.00 | S1PR3 (0.43) | S1PR3MAPTALDH1A1LMNAHTT | |
| SCHEMBL27952277 | 0.82 | S1PR3 (0.46) | S1PR3MAPTALDH1A1LMNAHTT | |
| SCHEMBL6949529 | 0.82 | CYP26A1 (0.56) | S1PR3ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL10256407 | 0.81 | MAPT (0.47) | MAPTALDH1A1LMNAHTTAAK1 | |
| SCHEMBL28807840 | 0.81 | S1PR3 (0.43) | S1PR3ALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL29833640 | 0.80 | CTSK (0.46) | MAPTALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL16971421 | 0.80 | CTSS (0.46) | MAPTSMN1; SMN2AAK1CTSKCTSS | |
| SCHEMBL614302 | 0.80 | CTSS (0.46) | MAPTSMN1; SMN2AAK1CTSKCTSS | |
| SCHEMBL30271848 | 0.80 | CTSS (0.46) | MAPTSMN1; SMN2AAK1CTSKCTSS | |
| SCHEMBL25300245 | 0.79 | S1PR3 (0.43) | S1PR3MAPTALDH1A1LMNAHTT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0865430-B1 | 3-(4-SUBST.-PIPERIDINYL-1)-1-(3,4-DICHLOROPHENYL)PROPYL CARBAMATES AND UREAS AND DERIVATIVES AS NOVEL NEUROKININ ANTAGONISTS | ASTRAZENECA AB (SE) | 2004-03-03 | — | — | EP | disclosed |
| US-6090824-A | Therapeutic neurokinin receptor antagonist compounds | ZENECA LIMITED (GB) | 2000-07-18 | — | — | US | disclosed |