Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7331788 | 0.96 | CA2 (0.33) | CA2CA4CA5ACTBP2RAB9A | |
| SCHEMBL362355 | 0.80 | CA2 (0.44) | CA2CA4CA5AKMT2APOLB | |
| SCHEMBL17099130 | 0.78 | NPSR1 (0.49) | CA2KMT2AKDM4ENPSR1TSHR | |
| SCHEMBL7331335 | 0.78 | KMT2A (0.48) | CA2CA4RAB9ANPC1KMT2A | |
| SCHEMBL7346734 | 0.76 | MAPT (0.39) | USP2MAPTTSHR | |
| SCHEMBL7326632 | 0.76 | ALDH1A1 (0.39) | KDM4EMAPT | |
| SCHEMBL7334090 | 0.75 | ALDH1A1 (0.38) | CA2CA4CA5ACTBP2RAB9A | |
| SCHEMBL7352882 | 0.74 | POLB (0.36) | KMT2AHPGDPOLBKDM4EMAPT | |
| SCHEMBL7350255 | 0.73 | TSHR (0.39) | KMT2AMAPTTSHRMEN1 | |
| SCHEMBL3787009 | 0.72 | ESR1 (0.54) | CA2CA4CA5AKMT2AHPGD |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4767749-A | CARDIOTONIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1988-08-30 | — | — | US | claimed |
| US-4894368-A | CARDIOVASCULAR DISORDERS, DIURETICS | AMERICAN CYANAMID COMPANY (US) | 1990-01-16 | — | — | US | disclosed |
| US-4767749-A | CARDIOTONIC AGENTS | AMERICAN CYANAMID COMPANY (US) | 1988-08-30 | — | — | US | disclosed |