Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.65 |
| ▸ | MAPT | P10636 | 10/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.65 |
| ▸ | HPGD | P15428 | 3/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.65 |
| ▸ | NPC1 | O15118 | 1/20 | 0.65 |
| ▸ | RAB9A | P51151 | 1/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.64 |
| ▸ | LMNA | P02545 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | DYRK2 | Q92630 | 6/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL11501954 | 1.00 | ALDH1A1 (0.65) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL31432619 | 0.79 | MAPT (1.00) | ALDH1A1MAPTKDM4ESMN1; SMN2HSD17B10 | |
| SCHEMBL11501581 | 0.77 | MAPT (0.75) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL11501580 | 0.77 | MAPT (0.75) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL11501993 | 0.75 | HSP90AA1 (0.55) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL11501994 | 0.75 | HSP90AA1 (0.55) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL8852927 | 0.75 | AKR1C3 (0.57) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL8145324 | 0.75 | AKR1C3 (0.57) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL8997928 | 0.75 | NPC1 (0.60) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD | |
| SCHEMBL8882040 | 0.75 | AKR1C3 (0.57) | ALDH1A1MAPTKDM4ESMN1; SMN2HPGD |
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-4177271-A | ANTIDEPRESSANTS, HYPNOTICS | UNICLER (FR) | 1979-12-04 | — | — | US | disclosed |