Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.57 |
| ▸ | APP | P05067 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 6/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.44 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 4/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.44 |
| ▸ | MPI | P34949 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8473083 | 0.77 | ACHE (0.41) | ACHEAPPMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8611412 | 0.77 | ACHE (0.41) | ACHEAPPMAPTSMN1; SMN2ALDH1A1 | |
| Atherospermidine SCHEMBL30723114 | 0.73 | ACHE (1.00) | ACHEAPPMAPTSMN1; SMN2ALDH1A1 | |
| Atherospermidine SCHEMBL6687528 | 0.73 | ACHE (1.00) | ACHEAPPMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL23111388 | 0.73 | CA1 (0.57) | APPMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL30629120 | 0.73 | CA1 (0.57) | APPMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL8076766 | 0.73 | CA1 (0.57) | APPMAPTSMN1; SMN2ALDH1A1KDM4E | |
| SCHEMBL29595732 | 0.73 | CA1 (0.57) | APPMAPTALDH1A1RAB9AHPGD | |
| SCHEMBL31237737 | 0.71 | PKM (0.56) | MAPTSMN1; SMN2ALDH1A1KDM4ENPC1 | |
| SCHEMBL10885799 | 0.69 | CA1 (0.53) | APPMAPTALDH1A1RAB9AHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5948817-A | Polycyclic ethyl alkylamide melatonergic agents | BRISTOL-MYERS SQUIBB COMPANY (US) | 1999-09-07 | — | — | US | disclosed |
| WO-1998038991-A1 | POLYCYCLIC ETHYL ALKYLAMIDE MELATONERGIC AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-09-11 | — | — | WO | disclosed |