Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGCR | P04035 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.37 |
| ▸ | CPT2 | P23786 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10580990 | 0.94 | HMGCR (0.43) | HMGCRCHRM1TBXA2RADRA1ACYP2C19 | |
| SCHEMBL10581603 | 0.84 | KMT2A (0.45) | TSHRFFAR3ALDH1A1FFAR1TDP1 | |
| SCHEMBL2393344 | 0.79 | TDP1 (0.45) | TSHRALDH1A1FFAR1CPT2TDP1 | |
| SCHEMBL25337653 | 0.76 | — | — | |
| SCHEMBL5830062 | 0.75 | TDP1 (0.41) | TSHRALDH1A1FFAR1CPT2TDP1 | |
| SCHEMBL11211995 | 0.74 | CYP2D6 (0.44) | HMGCRCHRM1TBXA2RADRA1ACYP2C19 | |
| T-Butylacetic Acid SCHEMBL31223224 | 0.74 | HMGCR (0.46) | HMGCRCHRM1TBXA2RADRA1ACYP2C19 | |
| SCHEMBL869890 | 0.74 | HMGCR (0.46) | HMGCRCHRM1TBXA2RADRA1ACYP2C19 | |
| SCHEMBL10579205 | 0.74 | KMT2A (0.50) | TSHRFFAR3ALDH1A1FFAR1TDP1 | |
| SCHEMBL869582 | 0.74 | HMGCR (0.46) | HMGCRCHRM1TBXA2RADRA1ACYP2C19 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2001036006-A1 | OPIOID METALLOPEPTIDE COMPOSITIONS AND METHODS | PALATIN TECHNOLOGIES, INC. (US) | 2001-05-25 | — | — | WO | disclosed |
| EP-0219275-A3 | VASOPRESSIN COMPOUNDS | SMITHKLINE BECKMAN CORPORATION (US) | 1989-05-03 | — | — | EP | disclosed |
| US-4749782-A | TREATING CONGESTIVE HEART FAILURE, HYPERTENSION | SMITHKLINE BECKMAN CORPORATION (US) | 1988-06-07 | — | — | US | disclosed |
| US-4749782-A | TREATING CONGESTIVE HEART FAILURE, HYPERTENSION | SMITHKLINE BECKMAN CORPORATION (US) | 1988-06-07 | — | — | US | disclosed |
| EP-0219275-A2 | Vasopressin compounds | SMITHKLINE BECKMAN CORPORATION (US) | 1987-04-22 | — | — | EP | disclosed |
| EP-0219275-A2 | Vasopressin compounds | SMITHKLINE BECKMAN CORPORATION (US) | 1987-04-22 | — | — | EP | disclosed |