Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 5/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5231227 | 1.00 | ALDH1A1 (0.39) | ALDH1A1TP53KMT2ANPC1RAB9A | |
| SCHEMBL5232572 | 0.86 | MAPT (0.39) | ALDH1A1RAB9AMAPTSMN1; SMN2CA2 | |
| SCHEMBL5232579 | 0.86 | MAPT (0.39) | ALDH1A1RAB9AMAPTSMN1; SMN2CA2 | |
| SCHEMBL8689025 | 0.82 | P2RX7 (0.38) | ALDH1A1TP53KMT2AMAPTMEN1 | |
| SCHEMBL5234088 | 0.81 | ALDH1A1 (0.45) | ALDH1A1TP53KMT2ANPC1RAB9A | |
| SCHEMBL8691503 | 0.78 | DRD2 (0.39) | ALDH1A1KMT2ARAB9APKMMAPT | |
| SCHEMBL5233477 | 0.78 | KMT2A (0.39) | ALDH1A1TP53KMT2ANPC1RAB9A | |
| SCHEMBL5233480 | 0.78 | KMT2A (0.39) | ALDH1A1TP53KMT2ANPC1RAB9A | |
| SCHEMBL5238511 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KMT2ANPC1MAPTMEN1 | |
| SCHEMBL5238517 | 0.74 | ALDH1A1 (0.39) | ALDH1A1KMT2ANPC1MAPTMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996022295-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1996-07-25 | — | — | WO | disclosed |
| US-5532235-A | TO TREAT EXCESS RENAL REABSORPTION | AMERICAN CYANAMID COMPANY (US) | 1996-07-02 | — | — | US | disclosed |