Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.53 |
| ▸ | TTK | P33981 | 1/20 | 0.53 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
| ▸ | INCENP | Q9NQS7 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.50 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.50 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.49 |
| ▸ | IKBKB | O14920 | 1/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.48 |
| ▸ | CDK9 | P50750 | 1/20 | 0.48 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | CCR8 | P51685 | 1/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL821691 | 0.79 | MEN1 (0.64) | MEN1KMT2ACYP1A2CYP2C19 | |
| Hydrochloric Acid SCHEMBL6923547 | 0.75 | MEN1 (0.49) | AURKATTKAURKBINCENPMAPK8 | |
| SCHEMBL19477097 | 0.75 | HRH3 (0.56) | HRH3HRH4MAPK8IKBKBIRAK4 | |
| SCHEMBL3512300 | 0.73 | TYK2 (0.52) | MAPK8CDK9EGFR | |
| SCHEMBL12389843 | 0.72 | IKBKB (0.58) | AURKBHRH3HRH4MAPK8IKBKB | |
| Hydrochloric Acid SCHEMBL3777082 | 0.71 | IKBKB (0.57) | AURKBHRH3HRH4MAPK8IKBKB | |
| SCHEMBL6878850 | 0.71 | MCHR1 (0.58) | AURKB | |
| SCHEMBL6878847 | 0.71 | MCHR1 (0.58) | AURKB | |
| SCHEMBL19073177 | 0.70 | KMT2A (0.64) | MEN1KMT2A | |
| SCHEMBL18549055 | 0.70 | KMT2A (0.64) | MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0912552-B1 | 2,4-DIAMINOPYRIMIDINE DERIVATES AS DOPAMINE D4 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA NV (BE) | 2004-04-21 | — | — | EP | disclosed |
| US-6395742-B1 | PSYCHOLOGICAL DISORDERS | JANSSEN PHARMACEUTICA N.V. (BE) | 2002-05-28 | — | — | US | disclosed |
| US-6159982-A | 2,4-diaminopyrimidine derivates as dopamine D4 receptor antagonist | JANSSEN PHARMACEUTICA N. V. (BE) | 2000-12-12 | — | — | US | disclosed |
| EP-0912552-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATES AS DOPAMINE D4 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1999-05-06 | — | — | EP | disclosed |
| WO-1997043279-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATES AS DOPAMINE D4 RECEPTOR ANTAGONISTS | JANSSEN PHARMACEUTICA N.V. (BE) | 1997-11-20 | — | — | WO | disclosed |