Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | TRPV6 | Q9H1D0 | 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL9679981 | 0.75 | AKR1C3 (0.59) | AKR1C3AKR1C1KDM4ENPC1RAB9A | |
| SCHEMBL6982271 | 0.74 | DHFR (0.45) | AKR1C3AKR1C1HTTHDAC4ALDH1A1 | |
| SCHEMBL6982266 | 0.74 | DHFR (0.45) | AKR1C3AKR1C1HTTHDAC4ALDH1A1 | |
| Bicarbonate SCHEMBL7573346 | 0.71 | AKR1C3 (0.63) | AKR1C3AKR1C1KDM4ENPC1RAB9A | |
| Bicarbonate SCHEMBL1720488 | 0.71 | AKR1C3 (0.63) | AKR1C3AKR1C1KDM4ENPC1RAB9A | |
| Propionamide SCHEMBL11825135 | 0.69 | AKR1C3 (0.49) | AKR1C3AKR1C1KDM4ENPC1RAB9A | |
| SCHEMBL3794846 | 0.69 | AKR1C3 (0.61) | AKR1C3AKR1C1HTTKDM4ENPC1 | |
| SCHEMBL31480957 | 0.69 | CA2 (0.55) | — | |
| Hydrogen Peroxide SCHEMBL2353767 | 0.69 | SLC18A3 (0.64) | AKR1C3AKR1C1NPC1RAB9AALDH1A1 | |
| SCHEMBL16536688 | 0.69 | AKR1C3 (0.61) | AKR1C3AKR1C1HTTKDM4ENPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6150362-A | ADMINISTERING 1,3,5-SUBSTITUTED TRIAZINE COMPOUNDS TO THE PATIENT SUFFERING FROM ANGIOGENIC DISEASES | ABBVIE INC. | 2000-11-21 | — | — | US | claimed |
| EP-1037886-B1 | TRIAZINE ANGIOGENESIS INHIBITORS | ABBOTT LAB (US) | 2003-05-02 | — | — | EP | disclosed |