Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3583245 | 0.82 | ALDH1A1 (0.47) | ALDH1A1RAB9AIDO1HTTHTR2A | |
| SCHEMBL9877543 | 0.77 | RAB9A (0.44) | ALDH1A1RAB9AIDO1HTTMAPT | |
| SCHEMBL9878438 | 0.76 | RAB9A (0.42) | ALDH1A1RAB9AIDO1HTTMAPT | |
| SCHEMBL9878069 | 0.75 | RAB9A (0.46) | ALDH1A1RAB9AIDO1HTTMAPT | |
| SCHEMBL11160866 | 0.74 | RAB9A (0.46) | ALDH1A1RAB9AIDO1MAPTSMN1; SMN2 | |
| SCHEMBL15618793 | 0.73 | ALDH1A1 (0.55) | ALDH1A1RAB9AIDO1HTTHTR2A | |
| SCHEMBL11085603 | 0.73 | IDO1 (0.54) | ALDH1A1RAB9AIDO1HTTHTR2A | |
| SCHEMBL11165854 | 0.73 | IDO1 (0.57) | ALDH1A1RAB9AIDO1HTTHTR2A | |
| SCHEMBL9877400 | 0.73 | RAB9A (0.45) | ALDH1A1RAB9AIDO1HTTHTR2A | |
| SCHEMBL8849145 | 0.73 | IDO1 (0.56) | ALDH1A1RAB9AIDO1HTTHTR2A |
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-4992542-A | Thienamycin antibiotics | MERCK & CO., INC. (US) | 1991-02-12 | — | — | US | disclosed |