Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 2/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1051623 | 0.89 | ALDH1A1 (0.51) | ALDH1A1HSD17B10TDP1MAOAMAOB | |
| SCHEMBL27040972 | 0.79 | P2RX7 (0.40) | ALDH1A1HSD17B10TDP1MAOAMAOB | |
| SCHEMBL10408514 | 0.79 | CA1 (0.41) | ALDH1A1HSD17B10TDP1KDM4EGLA | |
| SCHEMBL27040312 | 0.78 | ALDH1A1 (0.49) | ALDH1A1HSD17B10TDP1KDM4EHPGD | |
| SCHEMBL10408524 | 0.77 | CA1 (0.42) | ALDH1A1HSD17B10TDP1KDM4EKMT2A | |
| SCHEMBL28887497 | 0.75 | CYP1A2 (0.43) | ALDH1A1KDM4EHPGDKMT2APKM | |
| SCHEMBL3133065 | 0.75 | CDK2 (0.46) | ALDH1A1HSD17B10TDP1KDM4ESMN1; SMN2 | |
| SCHEMBL29904571 | 0.75 | CDK2 (0.46) | ALDH1A1HSD17B10TDP1KDM4ESMN1; SMN2 | |
| SCHEMBL11871336 | 0.74 | ALDH1A1 (0.50) | ALDH1A1HSD17B10TDP1KDM4ERAB9A | |
| SCHEMBL27041076 | 0.74 | TRPV4 (0.38) | ALDH1A1HSD17B10TDP1POLBTRPV4 |
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-5030631-A | Hypotensive, bronchodilator agents | SCHERING CORPORATION (US) | 1991-07-09 | — | — | US | disclosed |